smiles,solvent,peakwavs_max
B1C=Cc2c(ccc3ccccc23)N1,C1CCCCC1,345.0
B1C=Cc2cc3c(cc2N1)C=CBN3,C1CCCCC1,357.0
B1C=Cc2cc3ccccc3cc2N1,C1CCCCC1,359.0
B1C=Cc2ccc3ccccc3c2N1,C1CCCCC1,351.5
B1Nc2cccc3c2-n2c1ccc2BN3,ClCCl,316.0
B1Nc2ccccc2-c2ccccc21,C1CCCCC1,326.0
BPPB,CS(C)=O,505.0
BP[I]B,CS(C)=O,483.0
BrC1=CC=CN2B1C=Cc1c2ccc2ccccc12,C1CCCCC1,321.0
BrC1=CN2C[n+]3cc(Br)c4ccccc4c3N=C2c2ccccc21,CO,457.0
BrC1=CN2C[n+]3cc(Br)cc(Br)c3N=C2C(Br)=C1,CS(C)=O,449.0
BrCCCCCCCCCCCCOc1cc2ccc3cccc4ccc(c1)c2c34,Cc1ccccc1,384.0
Brc1cc(-c2ccccc2N(c2ccccc2)c2ccccc2)c(Br)cc1-c1ccccc1N(c1ccccc1)c1ccccc1,ClCCl,425.0
Brc1cc2nc3cc4c5c(cccc5c3nc2cc1Br)C(c1ccccc1)=C(c1ccccc1)O4,ClCCl,518.0
Brc1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1,CCO,315.0
Brc1ccc(-c2ccc(-c3ccccc3)cc2)cc1,CCOC(C)=O,461.0
Brc1ccc(-c2ccc(Br)cc2)cc1,CCOC(C)=O,399.0
Brc1ccc(-c2ccc3cc4ccccc4nc3n2)cc1,CC(C)=O,398.0
Brc1ccc(-c2cn3ccc(C=Cc4ccccc4)cc3n2)cc1,Cc1ccccc1,416.0
Brc1ccc(-c2cn3ccc(C=Cc4cccs4)cc3n2)cc1,Cc1ccccc1,393.0
Brc1ccc(-c2nc(-c3ccc(-c4nc(-c5ccc(Br)cc5)c(-c5ccc(Br)cc5)[nH]4)cc3)[nH]c2-c2ccc(Br)cc2)cc1,CS(C)=O,389.0
Brc1ccc(-c2nc(-c3ccc(C#Cc4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)nc(-c3ccc(C#Cc4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)n2)cc1,ClCCl,357.0
Brc1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1,ClC(Cl)Cl,323.0
Brc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClC(Cl)Cl,325.0
Brc1ccc(-c2nc3sc4ccccc4c3s2)cc1,CS(C)=O,353.0
Brc1ccc(-c2nnc3ccccn23)cc1,ClCCl,289.0
Brc1ccc(-n2cccc2)cc1,ClC(Cl)Cl,315.0
Brc1ccc(/C=C/c2ccncn2)cc1,ClCCl,317.0
Brc1ccc(/C=C/c2cnc3ccccc3n2)cc1,ClCCl,369.0
Brc1ccc(C2=C(c3ccc(Br)cc3)c3ccc4c5c(ccc(c35)O2)OC(c2ccc(Br)cc2)=C4c2ccc(Br)cc2)cc1,ClCCl,501.0
Brc1ccc(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)cc1,CCO,580.0
Brc1ccc(N(c2ccc(/C=C/c3ccncn3)cc2)c2ccc(/C=C/c3ccncn3)cc2)cc1,ClCCl,417.0
Brc1ccc(N/C=C/C=[NH+]c2ccc(Br)cc2)cc1,CS(C)=O,386.0
Brc1ccc(N2c3c(sc4ccccc34)Sc3sc4ccccc4c32)cc1,ClCCl,309.0
Brc1ccc(Nc2ccc3ccccc3n2)cc1,CCO,351.0
Brc1ccc(Nc2ccc3ccccc3n2)cc1,CCOC(C)=O,347.0
Brc1ccc(Nc2ccc3ccccc3n2)cc1,Cc1ccccc1,347.0
Brc1ccc2c(c1)C=C1B(N2)OB2Nc3ccc(Br)cc3C=C2C(c2ccccc2)=C1c1ccccc1,ClCCl,420.0
Brc1ccc2c(c1)CCc1nc(-c3ccccc3)c3c(c1-2)CCc1cc(Br)ccc1-3,ClC(Cl)Cl,343.0
Brc1ccc2cc3c4ccccc4nc(-c4ccco4)c3n2c1,CS(C)=O,411.0
Brc1cccc(C=NCCN=Cc2cccc(Br)c2)c1,ClCCl,244.0
Brc1ccccc1-c1ccc(-c2ccccc2)cc1,CCOC(C)=O,466.0
Brc1cnc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1,CO,369.0
Brc1cnc(-c2ccncc2)s1,CO,306.0
Brc1nnc(N=Nc2ccc(-c3cccs3)s2)s1,CS(C)=O,510.0
C#C/C(=C/c1cc2c3c(c1)CCCN3CCC2)C(=O)O,CN(C)C=O,441.0
C#C/C(=C/c1cc2c3c(c1)CCCN3CCC2)C(=O)[O-],CN(C)C=O,375.0
C#C/C(=C\c1ccc(-c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2c4c(c5c(c2-3)C(CCCCCC)(CCCCCC)c2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc2-5)C(CCCCCC)(CCCCCC)c2cc(-c3ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc3)ccc2-4)s1)C(=O)O,CC#N,474.0
C#CC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,C1COCCO1,405.0
C#CC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,CC#N,409.0
C#CC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,CCO,413.0
C#CC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,CS(C)=O,419.0
C#CC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,Cc1ccccc1,407.0
C#CC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,ClC(Cl)Cl,414.0
C#CC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,O,421.0
C#CC(C#C)=c1s/c(=c2/s/c(=C\c3ccc(N4c5ccccc5C5CCCC54)cc3)c(=O)n2CC(=O)O)c(=O)n1CCCCCCCC,ClC(Cl)Cl,541.0
C#CC1=CN2C(=N/[N+](=C/c3ccc(-c4cccs4)cc3)[B-]2(F)F)C=C1,CO,481.0
C#CC1CN2CCC1CC2[C@@H](O)c1ccnc2ccc(OC)cc12,C1CCOC1,332.0
C#CC1CN2CCC1CC2[C@@H](O)c1ccnc2ccc(OC)cc12,CC#N,332.0
C#CC1CN2CCC1CC2[C@@H](O)c1ccnc2ccc(OC)cc12,CCCC#N,332.0
C#CC1CN2CCC1CC2[C@@H](O)c1ccnc2ccc(OC)cc12,Cc1ccccc1,332.0
C#CC1CN2CCC1CC2[C@@H](O)c1ccnc2ccc(OC)cc12,ClCCl,333.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,C1COCCO1,357.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CC#N,358.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CC(C)=O,359.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CCCCO,366.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CCO,364.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CCOC(C)=O,357.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CN(C)C=O,364.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CO,363.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,CS(C)=O,366.0
C#CCN(C)c1ccc2c(c1)C(C)(C)c1cc(C(C)=O)ccc1-2,ClCCl,362.0
C#CCN(CC#C)CC#Cc1nn([C@H]2C[C@H](O)[C@@H](CO)O2)c2nc(NC(=O)C(C)C)[nH]c(=O)c12,CO,286.0
C#CCN(CC#C)CC#Cc1nn([C@H]2C[C@H](O)[C@@H](COC(c3ccccc3)(c3ccc(OC)cc3)c3ccc(OC)cc3)O2)c2nc(NC(=O)C(C)C)[nH]c(=O)c12,CO,274.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,C1COCCO1,396.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CC#N,395.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CC(C)=O,394.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CCCCCC,392.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CCCCO,400.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CCCO,400.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CCO,399.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CCOC(C)=O,393.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CN(C)C=O,399.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CO,398.0
C#CCN1C(=O)/C(=C/c2cc(OC(C)C)ccc2OC(C)C)N=C1C,CS(C)=O,401.0
C#CCN1CCN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)CC1,CCO,614.0
C#CCN1CCN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)CC1,ClC(Cl)Cl,629.0
C#CCNC1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,C1CCCCC1,468.5
C#CCNC1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC(C)=O,453.0
C#CCNC1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CCOC(C)=O,457.0
C#CCNC1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CO,453.0
C#CCNC1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,OCC(F)(F)F,450.5
C#CCNC1=C2C=C(c3cc4n(c3)[B-](F)(F)[N+]3=CC=CC3=C4c3c(C)cc(C)cc3C)C(C)=[N+]2[B-](F)(F)n2c(C)ccc21,C1CCCCC1,568.0
C#CCNC1=C2C=C(c3cc4n(c3)[B-](F)(F)[N+]3=CC=CC3=C4c3c(C)cc(C)cc3C)C(C)=[N+]2[B-](F)(F)n2c(C)ccc21,CCOC(C)=O,568.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,C1CCCCC1,424.25
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CC(C)=O,406.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCCCO,406.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCCO,408.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCO,406.25
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCOC(C)=O,408.5
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CN(C)C=O,404.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CO,403.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CS(C)=O,404.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,Cc1ccccc1,421.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,ClC(Cl)Cl,418.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,OCC(F)(F)F,404.0
C#CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,c1ccccc1,422.0
C#CCOc1ccc(-c2cc(-c3ccccc3)c3n2[B-](F)(F)[N+]2=C(c4ccc(OCCCS(=O)(=O)[O-])cc4)C=C(c4ccccc4)C2=N3)cc1,O,690.0
C#CCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(N(C)C)cc4)c4c(C)cc(C)n4[B-]3(F)F)C(C)=C2)cc1,CO,567.0
C#CCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(N(C)CC)cc4)c4c(C)cc(C)n4[B-]3(F)F)C(C)=C2)cc1,CO,569.0
C#CCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(N(CC)CC)cc4)c4c(C)cc(/C=C/c5ccc(OCC(=O)OC)cc5)n4[B-]3(F)F)C(C)=C2)cc1,CO,640.0
C#CCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(N(CC)CC)cc4)c4c(C)cc(/C=C/c5ccc(S(=O)(=O)O)cc5S(=O)(=O)O)n4[B-]3(F)F)C(C)=C2)cc1,O,643.0
C#CCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(N(CC)CC)cc4)c4c(C)cc(C)n4[B-]3(F)F)C(C)=C2)cc1,CO,568.0
C#CCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(N5CCCCC5)cc4)c4c(C)cc(C)n4[B-]3(F)F)C(C)=C2)cc1,CO,568.0
C#CCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccccc4)c4c(C)cc(C)n4[B-]3(F)F)C(C)=C2)cc1,CO,563.0
C#CCOc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)cc(-c5ccc(O)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2)cc1,CO,688.0
C#CCOc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)cc(-c5ccc(O)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2)cc1,Cc1ccccc1,685.0
C#CCOc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)cc(-c5ccc(O)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2)cc1,ClC(Cl)Cl,680.0
C#CC[NH+]=C1c2cccn2[B-](F)(F)n2cccc21,CCOC(C)=O,408.5
C#CCn1c2ccccc2c2cc(/C=C/C3=[N+]4C(=C(c5ccc(I)cc5)c5c(C)c(Cl)c(/C=C/c6ccc7c(c6)c6ccccc6n7CC#C)n5[B-]4(F)F)C(C)=C3Cl)ccc21,CC#N,694.0
C#CCn1c2ccccc2c2cc(/C=C/C3=[N+]4C(=C(c5ccc(I)cc5)c5c(C)c(Cl)c(/C=C/c6ccc7c(c6)c6ccccc6n7CC#C)n5[B-]4(F)F)C(C)=C3Cl)ccc21,CS(C)=O,705.0
C#CCn1c2ccccc2c2cc(/C=C/C3=[N+]4C(=C(c5ccc(I)cc5)c5c(C)c(Cl)c(/C=C/c6ccc7c(c6)c6ccccc6n7CC#C)n5[B-]4(F)F)C(C)=C3Cl)ccc21,ClC(Cl)Cl,703.0
C#CCn1c2ccccc2c2cc(/C=C/C3=[N+]4C(=C(c5ccc(I)cc5)c5c(C)cc(/C=C/c6ccc7c(c6)c6ccccc6n7CC#C)n5[B-]4(F)F)C(C)=C3)ccc21,CC#N,665.0
C#CCn1c2ccccc2c2cc(/C=C/C3=[N+]4C(=C(c5ccc(I)cc5)c5c(C)cc(/C=C/c6ccc7c(c6)c6ccccc6n7CC#C)n5[B-]4(F)F)C(C)=C3)ccc21,CS(C)=O,678.0
C#CCn1c2ccccc2c2cc(/C=C/C3=[N+]4C(=C(c5ccc(I)cc5)c5c(C)cc(/C=C/c6ccc7c(c6)c6ccccc6n7CC#C)n5[B-]4(F)F)C(C)=C3)ccc21,ClC(Cl)Cl,674.0
C#CCn1c2ccccc2c2cc(/C=C/c3c(Cl)c(C)c4n3[B-](F)(F)[N+]3=C(C)C(Cl)=C(C)C3=C4c3ccc(I)cc3)ccc21,CC#N,606.0
C#CCn1c2ccccc2c2cc(/C=C/c3c(Cl)c(C)c4n3[B-](F)(F)[N+]3=C(C)C(Cl)=C(C)C3=C4c3ccc(I)cc3)ccc21,CS(C)=O,616.0
C#CCn1c2ccccc2c2cc(/C=C/c3c(Cl)c(C)c4n3[B-](F)(F)[N+]3=C(C)C(Cl)=C(C)C3=C4c3ccc(I)cc3)ccc21,ClC(Cl)Cl,619.0
C#CCn1c2ccccc2c2cc(C(=O)OC)nc(-c3nc4c(C)cc(C)cc4[nH]3)c21,ClC(Cl)Cl,383.73
C#Cc1cc(C=C(C#N)C(=O)O)ccc1C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,424.0
C#Cc1ccc(-c2c3nc(c(-c4ccc(C#C)cc4)c4ccc([nH]4)c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4cc(c(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c5ccc2[nH]5)C=N4)C=C3)cc1,ClCCl,727.0
C#Cc1ccc(-c2nc(-c3ccc(C#C)s3)nc(-c3ccc(C#C)s3)n2)s1,ClCCl,348.0
C#Cc1ccc(/C=C/c2ccc3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc1,CCO,567.0
C#Cc1ccc(C#Cc2cnc(C#Cc3ccccc3)nc2)cc1,C1CCCCC1,325.0
C#Cc1ccc(C(=O)c2cc(C#C)c3ccc4c(C#C)cc(C#C)c5ccc2c3c45)cc1,CCCCCC,428.0
C#Cc1ccc(C=C(C#N)C(=O)O)cc1C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,350.0
C#Cc1ccc(N(c2ccc(C#Cc3ccc(OC)nn3)cc2)c2ccc(C#Cc3ccc(OC)nn3)cc2)cc1,ClCCl,367.0
C#Cc1ccc2c(c1-c1cn([C@H]3C[C@H](O)[C@@H](CO)O3)c(=O)[nH]c1=O)C(=O)c1ccccc1-2,O,345.0
C#Cc1ccc2cc(/C=C/C(=O)OCC)c(=O)oc2c1,CCO,360.0
C#Cc1ccc2cc(N(C)C)ccc2c1,CC#N,325.0
C#Cc1ccc2cc(N(C)C)ccc2c1,Cc1ccccc1,325.0
C#Cc1ccc2cc(N(C)C)ccc2c1,O,314.0
C#Cc1ccc2cc3c(C)cc(=O)oc3cc2c1,CCO,334.0
C#Cc1ccc2ccc3cccc4ccc1c2c34,C1CCCCC1,357.0
C#Cc1ccc2ccc3cccc4ccc1c2c34,CC#N,356.0
C#Cc1ccc2ccc3cccc4ccc1c2c34,CO,355.0
C#Cc1ccc2ccc3cccc4ccc1c2c34,ClCCl,358.0
C#Cc1ccc2ccc3oc(=O)cc(C)c3c2c1,CCO,362.0
C#Cc1cccc2ccccc12,C1CCCCC1,310.0
C#Cc1cccc2ccccc12,CC#N,306.0
C#Cc1cccc2ccccc12,CO,309.0
C#Cc1cccc2ccccc12,ClCCl,312.0
C#Cc1ccnc(-c2cc(-c3cc(C#C)ccn3)cc(-c3cc(C#C)ccn3)c2)c1,CC1COC(=O)O1,284.0
C#Cc1nc(C=Cc2ccc(OC)cc2)cc(C=Cc2ccc(OC)cc2)n1,ClCCl,364.0
C#Cn1c(-c2cc(-c3nc4ccc(C)cc4n3C#C)cc(-c3nc4ccc(C)cc4n3C#C)c2)nc2ccc(C)cc21,ClCCl,306.5
C#Cn1c(-c2cc(-c3nc4ccccc4n3C#C)cc(-c3nc4ccccc4n3C#C)c2)nc2ccccc21,ClCCl,305.5
C(#Cc1c(C#Cc2ccccc2)c(C#Cc2ccccc2)c(C#Cc2ccccc2)c(C#Cc2ccccc2)c1C#Cc1ccccc1)c1ccccc1,ClCCl,371.0
C(#Cc1c(C#Cc2cccs2)c(C#Cc2cccs2)c(C#Cc2cccs2)c(C#Cc2cccs2)c1C#Cc1cccs1)c1cccs1,ClCCl,371.0
C(#Cc1c2ccccc2c(-c2ccccc2)c2cc3ccccc3cc12)c1ccccc1,ClCCl,522.0
C(#Cc1c2ccccc2c(C#Cc2ccccc2)c2ccccc12)c1ccccc1,C1CCCCC1,451.0
C(#Cc1c2ccccc2c(C#Cc2ccccc2)c2ccccc12)c1ccccc1,ClCCl,464.0
C(#Cc1cc(C#Cc2ccc(C=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)cc2)ncn1)c1ccc(C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)cc1,ClCCl,614.0
C(#Cc1cc(C#Cc2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)c2ccc3c(C#Cc4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc(C#Cc4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)c4ccc1c2c43)c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,501.0
C(#Cc1cc(C#Cc2ccccc2)c(C#Cc2ccccc2)c(C#Cc2ccccc2)c1C#Cc1ccccc1)c1ccccc1,ClCCl,364.0
C(#Cc1cc(C#Cc2ccccc2)nc(C#Cc2ccccc2)n1)c1ccccc1,ClC(Cl)Cl,341.0
C(#Cc1cc(C#Cc2cccs2)c(C#Cc2cccs2)c(C#Cc2cccs2)c1C#Cc1cccs1)c1cccs1,ClCCl,372.0
C(#Cc1cc2ccc3cc(C#Cc4ccccc4)cc4ccc(c1)c2c34)c1ccccc1,Cc1ccccc1,410.0
C(#Cc1cc2ccc3cccc4ccc(c1)c2c34)c1ccccc1,Cc1ccccc1,390.0
C(#Cc1ccc(-c2ccccc2)nn1)c1ccc(N(c2ccc(C#Cc3ccc(-c4ccccc4)nn3)cc2)c2ccc(C#Cc3ccc(-c4ccccc4)nn3)cc2)cc1,ClCCl,394.0
C(#Cc1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,372.0
C(#Cc1ccc(C#Cc2ccc(C#Cc3ccccc3)cc2)cc1)c1ccccc1,ClC(Cl)Cl,345.0
C(#Cc1ccc(C#Cc2ccccc2)cc1)c1ccccc1,ClC(Cl)Cl,328.0
C(#Cc1ccc(N(c2ccc(C#Cc3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)c2ccc(C#Cc3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)cc1)c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1,C1CCOC1,379.0
C(#Cc1ccc(N(c2ccc(C#Cc3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)c2ccc(C#Cc3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)cc1)c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1,Cc1ccccc1,378.0
C(#Cc1ccc(N(c2ccc(C#Cc3ccc(C=Cc4ccncn4)cc3)cc2)c2ccc(C#Cc3ccc(C=Cc4ccncn4)cc3)cc2)cc1)c1ccc(C=Cc2ccncn2)cc1,ClCCl,441.0
C(#Cc1ccc(N(c2ccc(C#Cc3ccc(C=Cc4cnc5ccccc5n4)cc3)cc2)c2ccc(C#Cc3ccc(C=Cc4cnc5ccccc5n4)cc3)cc2)cc1)c1ccc(C=Cc2cnc3ccccc3n2)cc1,CCCCCC,458.0
C(#Cc1ccc(N(c2ccc(C#Cc3ccc(C=Cc4cnccn4)cc3)cc2)c2ccc(C#Cc3ccc(C=Cc4cnccn4)cc3)cc2)cc1)c1ccc(C=Cc2cnccn2)cc1,ClCCl,432.0
C(#Cc1ccc([P+](CCC[P+](c2ccccc2)(c2ccccc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)(c2ccccc2)c2ccccc2)c2ccccc12)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,420.0
C(#Cc1ccc([P+](CCC[P+](c2ccccc2)(c2ccccc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)(c2ccccc2)c2ccccc2)c2ccccc12)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CO,427.0
C(#Cc1ccc([P+](CCC[P+](c2ccccc2)(c2ccccc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)(c2ccccc2)c2ccccc2)c2ccccc12)c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,437.0
C(#Cc1ccc2c(c1)Cc1ccccc1-2)c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,404.0
C(#Cc1ccc2ccccc2c1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,372.0
C(#Cc1ccc2ncsc2c1)c1ccc(N(c2ccc(C#Cc3ccc4ncsc4c3)cc2)c2ccc(C#Cc3ccc4ncsc4c3)cc2)cc1,Cc1ccccc1,380.0
C(#Cc1ccc2ncsc2c1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,365.0
C(#Cc1cccc2cc(-c3ccccc3)c3cc(-c4cc[b-]5c(c4)c(-c4ccccc4)cc4cccc(C#Cc6ccccc6)[n+]54)cc[b-]3[n+]12)c1ccccc1,C1CCCCC1,546.0
C(#Cc1cccc2ccccc12)c1ncc(-c2ccccc2)o1,ClCCl,350.0
C(#Cc1ccccc1)C(C#Cc1ccccc1)=Cc1c2ccccc2c(C=C(C#Cc2ccccc2)C#Cc2ccccc2)c2ccccc12,ClC(Cl)Cl,432.0
C(#Cc1ccccc1)C(C#Cc1ccccc1)=Cc1ccc(C=C(C#Cc2ccccc2)C#Cc2ccccc2)cc1,ClC(Cl)Cl,416.0
C(#Cc1ccccc1)C(C#Cc1ccccc1)=Cc1ccc(C=C(C#Cc2ccccc2)C#Cc2ccccc2)s1,ClC(Cl)Cl,468.0
C(#Cc1ccccc1)C(C#Cc1ccccc1)=Cc1ccc2cc(C=C(C#Cc3ccccc3)C#Cc3ccccc3)ccc2c1,ClC(Cl)Cl,418.0
C(#Cc1ccccc1)C(C#Cc1ccccc1)=Cc1ccccc1,ClC(Cl)Cl,340.0
C(#Cc1ccccc1)C(C#Cc1ccccc1)=c1c2ccccc2c(=C(C#Cc2ccccc2)C#Cc2ccccc2)c2ccccc12,ClC(Cl)Cl,540.0
C(#Cc1ccccc1)C1=CC=CN2B1C=Cc1c2ccc2ccccc12,C1CCCCC1,348.0
C(#Cc1ccccc1)c1ccccc1,CCO,373.0
C(#Cc1ccccc1)c1ccccc1,CCOC(C)=O,406.0
C(#Cc1ccccc1)c1ccccc1,CO,298.0
C(#Cc1ccccc1)c1ccccc1,ClC(Cl)Cl,299.0
C(#Cc1ccccc1)c1ccccc1,ClCCl,299.0
C(#Cc1ccccc1C#Cc1ccccc1)c1ccccc1,CC#N,310.0
C(#Cc1cccs1)C(C#Cc1cccs1)=Cc1ccc(C=C(C#Cc2cccs2)C#Cc2cccs2)cc1,ClC(Cl)Cl,438.0
C(#Cc1cccs1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,332.0
C(#Cc1cccs1)c1ncc(-c2ccccc2)o1,ClCCl,325.0
C(#Cc1ccncc1)C(C#Cc1ccncc1)=Cc1ccc(C=C(C#Cc2ccncc2)C#Cc2ccncc2)cc1,ClC(Cl)Cl,420.0
C(#Cc1nc(C#Cc2ccccc2)c(C#Cc2ccccc2)c(C#Cc2ccccc2)c1C#Cc1ccccc1)c1ccccc1,ClCCl,421.0
C(#Cc1nc(C#Cc2cccs2)c(C#Cc2cccs2)c(C#Cc2cccs2)c1C#Cc1cccs1)c1cccs1,ClCCl,411.0
C(#Cc1nc2ccccc2s1)c1ccc(N(c2ccc(C#Cc3nc4ccccc4s3)cc2)c2ccc(C#Cc3nc4ccccc4s3)cc2)cc1,Cc1ccccc1,404.0
C(#Cc1nc2ccccc2s1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,388.0
C(#Cc1ncc(-c2ccccc2)o1)c1ccco1,ClCCl,325.0
C(#Cc1nccnc1C#Cc1ccccc1)c1ccccc1,CC#N,315.0
C(/C=C/Nc1cccc2ccccc12)=[NH+]c1cccc2ccccc12,CS(C)=O,391.0
C(/C=C/c1cc2c3c(c1)CCCN3CCC2)=C\c1ccncc1,C1COCCO1,413.0
C(/C=C/c1cc2c3c(c1)CCCN3CCC2)=C\c1ccncc1,CC#N,413.0
C(/C=C/c1cc2c3c(c1)CCCN3CCC2)=C\c1ccncc1,CCCCCCC,403.0
C(/C=C/c1cc2c3c(c1)CCCN3CCC2)=C\c1ccncc1,CO,419.0
C(/C=C/c1ccc(-n2c3ccccc3c3ccccc32)cc1)=C\c1ccncc1,C1COCCO1,356.0
C(/C=C/c1ccc(-n2c3ccccc3c3ccccc32)cc1)=C\c1ccncc1,CC#N,350.0
C(/C=C/c1ccc(-n2c3ccccc3c3ccccc32)cc1)=C\c1ccncc1,CCCCCCC,360.0
C(/C=C/c1ccc(-n2c3ccccc3c3ccccc32)cc1)=C\c1ccncc1,CO,353.0
C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)=C\c1ccncc1,C1COCCO1,395.0
C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)=C\c1ccncc1,CC#N,396.0
C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)=C\c1ccncc1,CCCCCCC,393.0
C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)=C\c1ccncc1,CO,399.0
C(/C=C/c1ccc2ncnc(Nc3ccccc3)c2c1)=C\c1ccccc1,ClC(Cl)Cl,361.0
C(=C(c1ccccc1)c1ccccc1)=C1c2c(ccc3cc(C=Cc4ccccc4)ccc23)OC1(c1ccccc1)c1ccccc1,C1CCOC1,464.0
C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2cc(-c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)cc(-c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)c2)cc1,C1CCOC1,333.0
C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(-c3nc4c5ccccc5c5ccccc5c4n3-c3cccc(-c4ccc(C=C(c5ccccc5)c5ccccc5)cc4)c3)cc2)cc1,C1CCOC1,340.0
C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,351.0
C(=C(c1ccccc1)c1ccccc1)c1ccc(C=C(c2ccccc2)c2ccccc2)cc1,C1CCOC1,352.0
C(=C(c1nnn[nH]1)c1nnn[nH]1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCO,370.0
C(=C/N(c1ccccc1)c1ccccc1)\c1ccc(-c2cccc3nsnc23)cc1,Cc1ccccc1,426.0
C(=C/N1CCCC1)\c1nc2ccccc2nc1-c1ccccc1,CC#N,438.0
C(=C/c1[nH+]ccc2ccccc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,512.0
C(=C/c1c2ccccc2cc2ccccc12)\c1c2ccccc2cc2ccccc12,C1CCOC1,400.0
C(=C/c1c2ccccc2cc2ccccc12)\c1ccc2ccccc2n1,CC#N,390.0
C(=C/c1c2ccccc2cc2ccccc12)\c1ccc2ccccc2n1,CC1CCCCC1,390.0
C(=C/c1c2ccccc2cc2ccccc12)\c1cccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)c1,CCCCCC,375.0
C(=C/c1c2ccccc2cc2ccccc12)\c1cccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)c1,CS(C)=O,383.0
C(=C/c1c2ccccc2cc2ccccc12)\c1cccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)c1,ClCCl,379.0
C(=C/c1c2ccccc2cc2ccccc12)\c1cccc2ccccc12,CC#N,386.0
C(=C/c1c2ccccc2cc2ccccc12)\c1cccc2ccccc12,CC1CCCCC1,386.0
C(=C/c1c2ccccc2cc2ccccc12)\c1ccccc1/C=C/c1ccc2ccc3cccc4ccc1c2c34,CCCCCC,370.0
C(=C/c1c2ccccc2cc2ccccc12)\c1ccccc1/C=C/c1ccc2ccc3cccc4ccc1c2c34,CS(C)=O,379.0
C(=C/c1c2ccccc2cc2ccccc12)\c1ccccc1/C=C/c1ccc2ccc3cccc4ccc1c2c34,ClCCl,375.0
C(=C/c1c[nH]c2ccccc12)\c1cc[n+]2ccc(/C=C/c3c[nH]c4ccccc34)cc2c1,CO,489.0
C(=C/c1cc(-c2ccc3ccccc3c2)c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1-c1ccc2ccccc2c1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,419.0
C(=C/c1cc(-c2ccccc2)c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1-c1ccccc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,415.0
C(=C/c1cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,343.0
C(=C/c1cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,CC#N,344.0
C(=C/c1cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,Cc1ccccc1,345.0
C(=C/c1cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)c1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,344.0
C(=C/c1cc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,415.0
C(=C/c1cc(/C=C/c2ccccc2)cc(/C=C/c2ccccc2)c1)\c1ccccc1,ClCCl,317.0
C(=C/c1cc(/C=C/c2ccccc2)nc(/C=C/c2ccccc2)n1)\c1ccccc1,ClCCl,312.0
C(=C/c1cc2ccccc2c2ccccc12)\c1c2ccccc2cc2ccccc12,C1CCOC1,388.0
C(=C/c1cc2ccccc2c2ccccc12)\c1cc2ccccc2c2ccccc12,C1CCOC1,340.0
C(=C/c1cc[n+]2ccc(/C=C/c3cc[nH]c3)cc2c1)\c1cc[nH]c1,CO,457.0
C(=C/c1cc[n+]2ccc(/C=C/c3ccsc3)cc2c1)\c1ccsc1,CO,432.0
C(=C/c1cc[nH+]c2ccccc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,509.0
C(=C/c1ccc(-c2ccc(/C=C/c3ccc(-n4c5ccccc5c5ccccc54)cc3)s2)s1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,Cc1ccccc1,440.2214022
C(=C/c1ccc(-c2cccc3ccccc23)s1)\c1ccc(-c2cccc3ccccc23)s1,ClCCl,388.0
C(=C/c1ccc(-c2cccc3ccccc23)s1)\c1cccs1,ClCCl,370.0
C(=C/c1ccc(-c2ccccc2)cc1)\c1ccc(Oc2ccc3ccccc3c2-c2c(Oc3ccc(/C=C/c4ccc(-c5ccccc5)cc4)cc3)ccc3ccccc23)cc1,ClCCl,328.0
C(=C/c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1)\c1ccncc1,C1CCOC1,367.0
C(=C/c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1)\c1ccncc1,CC#N,357.0
C(=C/c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1)\c1ccncc1,CO,349.0
C(=C/c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1)\c1ccncc1,ClCCl,363.0
C(=C/c1ccc(-c2nnc(-c3ccc(/C=C/c4ccc(-c5nc(-c6ccccc6)c(-c6ccccc6)[nH]5)cc4)cc3)o2)cc1)\c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1,C1CCOC1,396.0
C(=C/c1ccc(-c2nnc(-c3ccc(/C=C/c4ccc(-c5nc(-c6ccccc6)c(-c6ccccc6)[nH]5)cc4)cc3)o2)cc1)\c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1,CC#N,391.0
C(=C/c1ccc(-c2nnc(-c3ccc(/C=C/c4ccc(-c5nc(-c6ccccc6)c(-c6ccccc6)[nH]5)cc4)cc3)o2)cc1)\c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1,CN(C)C=O,397.0
C(=C/c1ccc(-c2nnc(-c3ccc(/C=C/c4ccc(-c5nc(-c6ccccc6)c(-c6ccccc6)[nH]5)cc4)cc3)o2)cc1)\c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1,Cc1ccccc1,397.0
C(=C/c1ccc(-c2nnc(-c3ccccc3)o2)cc1)\c1ccc(-c2nnc(-c3ccccc3)o2)cc1,CN(C)C=O,347.0
C(=C/c1ccc(-n2c3ccccc3c3ccccc32)cc1)\c1ccc(-c2ccc(/C=C/c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1,Cc1ccccc1,370.0
C(=C/c1ccc(-n2c3ccccc3c3ccccc32)cc1)\c1ccc(-c2ccc(/C=C/c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,389.0
C(=C/c1ccc(/C=C/c2c3ccccc3cc3ccccc23)cc1)\c1ccncc1,C1CCOC1,390.0
C(=C/c1ccc(/C=C/c2cccs2)s1)\c1cccs1,CC#N,423.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)c2ccc(/C=C/c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)cc1)\c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1,C1CCOC1,411.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)c2ccc(/C=C/c3ccc(-c4cc(-c5ccccc5)nc(-c5ccccc5)c4)cc3)cc2)cc1)\c1ccc(-c2cc(-c3ccccc3)nc(-c3ccccc3)c2)cc1,Cc1ccccc1,410.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccc(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)c4ccc(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,380.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccc(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)c4ccc(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,375.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(/C=C/c3ccc(/C=C/c4ccc(N(c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4)c4nsnc34)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,529.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(/C=C/c3ccc(/C=C/c4ccc(N(c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4)c4nsnc34)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCOC(C)=O,518.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(/C=C/c3ccc(/C=C/c4ccc(N(c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4)c4nsnc34)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,528.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(/C=C/c3ccc(/C=C/c4ccc(N(c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4)c4nsnc34)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,528.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(/C=C/c3ccc(/C=C/c4ccc(N(c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4)c4nsnc34)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,527.0
C(=C/c1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(/C=C/c3ccc(/C=C/c4ccc(N(c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)c5ccc(/C=C/c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4)c4nsnc34)cc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,527.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,C1CCOC1,382.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,C1COCCO1,382.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,CC#N,379.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,CCO,379.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,ClCCl,383.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(-c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1,ClCCl,398.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(-c2nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)n2)cc1,ClC(Cl)Cl,421.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccccc1,CC#N,362.0
C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccccc1,CCCCCC,362.0
C(=C/c1ccc(N2CCCCC2)c2nsnc12)\c1ccncc1,ClCCl,470.0
C(=C/c1ccc(N2CCOCC2)c2nsnc12)\c1ccncc1,ClCCl,454.0
C(=C/c1ccc(Nc2ccccc2)cc1)\c1ccccc1,CC#N,351.0
C(=C/c1ccc(Nc2ccccc2)cc1)\c1ccccc1,CCCCCC,346.0
C(=C/c1ccc2ccccc2[nH+]1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,509.0
C(=C/c1ccc2ccccc2c1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,371.0
C(=C/c1ccc2ccccc2c1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCCCCC,371.0
C(=C/c1ccc2ccccc2n1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,399.0
C(=C/c1ccc2ccccc2n1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,399.0
C(=C/c1ccc2ncnc(Nc3ccccc3)c2c1)\c1ccccc1,ClC(Cl)Cl,341.0
C(=C/c1cccc(/C=C/c2c3ccccc3cc3ccccc23)c1)\c1ccncc1,C1CCOC1,388.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CC#N,349.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CC(C)=O,350.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CCCCCCCC,354.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CCCCCCCCCCO,360.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CCCCCCCCO,359.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CCCCCO,356.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CCCO,342.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CN(C)C=O,357.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CO,351.0
C(=C/c1cccc2ccccc12)\c1ccc(-c2nnc(-c3ccc(-c4cc5ccccc5s4)cc3)o2)cc1,CS(C)=O,360.0
C(=C/c1cccc2ccccc12)\c1ccc(Oc2ccc3ccccc3c2-c2c(Oc3ccc(/C=C/c4cccc5ccccc45)cc3)ccc3ccccc23)cc1,ClCCl,334.0
C(=C/c1cccc2ccccc12)\c1ncc(-c2ccccc2)o1,ClCCl,357.0
C(=C/c1ccccc1)\c1ccccc1,CC#N,307.0
C(=C/c1ccccn1)\c1ccc(N(c2ccc(/C=C/c3ccccn3)cc2)c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccc(/C=C/c5ccccn5)cc4)c4ccc(/C=C/c5ccccn5)cc4)cc3)cc2)cc1,C1CCOC1,383.0
C(=C/c1ccccn1)\c1ccc(N(c2ccc(/C=C/c3ccccn3)cc2)c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccc(/C=C/c5ccccn5)cc4)c4ccc(/C=C/c5ccccn5)cc4)cc3)cc2)cc1,Cc1ccccc1,378.0
C(=C/c1cccnc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,367.0
C(=C/c1cccnc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCCCCC,358.0
C(=C/c1cccnc1)\c1ccc(Nc2ccccc2)cc1,CC#N,358.0
C(=C/c1cccnc1)\c1ccc(Nc2ccccc2)cc1,CCCCCC,352.0
C(=C/c1ccnc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,402.0
C(=C/c1ccnc2ccccc12)\c1c2ccccc2cc2ccccc12,CC#N,387.0
C(=C/c1ccnc2ccccc12)\c1c2ccccc2cc2ccccc12,CC1CCCCC1,387.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,C1CCCCC1,364.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,C1COCCO1,370.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CC#N,370.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CC(C)=O,371.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CC(C)O,374.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CCCO,374.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CCO,374.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CN(C)C=O,378.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CO,374.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,CS(C)=O,382.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,ClC(Cl)Cl,370.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,ClCCl,370.0
C(=C/c1ccnc2ccccc12)\c1ccc(/C=C/c2ccnc3ccccc23)cc1,OCCO,382.0
C(=C/c1ccnc2ccccc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,397.0
C(=C/c1ccnc2ccccc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,397.0
C(=C/c1ccncn1)\c1ccc(-c2ccco2)cc1,ClCCl,337.0
C(=C/c1ccncn1)\c1ccc(N(c2ccccc2)c2ccc(/C=C/c3ccncn3)cc2)cc1,ClCCl,422.0
C(=C/c1cnc2ccccc2n1)\c1ccc(N2CCCCC2)cc1,C1CCOC1,410.0
C(=C/c1cnc2ccccc2n1)\c1ccc(N2CCCCC2)cc1,CC#N,410.0
C(=C/c1cnc2ccccc2n1)\c1ccc(N2CCCCC2)cc1,CCCCCCC,402.0
C(=C/c1cnc2ccccc2n1)\c1ccc(N2CCCCC2)cc1,CS(C)=O,423.0
C(=C/c1cnc2ccccc2n1)\c1ccc(N2CCCCC2)cc1,ClCCl,414.0
C(=C/c1cnccn1)\c1ccc(N(c2ccccc2)c2ccc(/C=C/c3cnccn3)cc2)cc1,ClCCl,420.0
C(=C/c1cnccn1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,393.0
C(=C/c1cnccn1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,391.0
C(=C/c1cnccn1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CS(C)=O,400.0
C(=C/c1cnccn1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,394.0
C(=C/c1nc(-c2ccccc2)[nH]c1/C=C/c1ccccc1)\c1ccccc1,ClCCl,365.0
C(=C/c1nc(-c2ccccc2)c2ccccn12)\c1nc(-c2ccccc2)c2ccccn12,CC#N,438.0
C(=C/c1nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,381.0
C(=C/c1nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,CC#N,376.0
C(=C/c1nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,Cc1ccccc1,389.0
C(=C/c1nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1)\c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,383.0
C(=C/c1nc(/C=C/c2ccccc2)nc(/C=C/c2ccccc2)n1)\c1ccccc1,ClCCl,327.0
C(=C/c1nc2c(c(N3CCOCC3)n1)CCCC2)\c1ccccc1,ClCCl,284.0
C(=C/c1nc2c3ccccc3c3ccccc3c2o1)\c1ccccc1,CC#N,364.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,C1CCOC1,381.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,CC#N,376.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,CO,375.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,ClCCl,382.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(/C=C/c2nc3ccccc3[nH]2)cc1,C1CCOC1,389.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(/C=C/c2nc3ccccc3[nH]2)cc1,CC#N,382.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(/C=C/c2nc3ccccc3[nH]2)cc1,CC(C)=O,395.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(/C=C/c2nc3ccccc3[nH]2)cc1,CN(C)C=O,390.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(/C=C/c2nc3ccccc3[nH]2)cc1,CO,384.0
C(=C/c1nc2ccccc2[nH]1)\c1ccc(/C=C/c2nc3ccccc3[nH]2)cc1,CS(C)=O,392.0
C(=C/c1nc2ccccc2o1)\c1ccc(Cn2cc(-c3ccc(N(c4ccc(-c5cn(Cc6ccc(/C=C/c7nc8ccccc8o7)cc6)nn5)cc4)c4ccc(-c5cn(Cc6ccc(/C=C/c7nc8ccccc8o7)cc6)nn5)cc4)cc3)nn2)cc1,CN(C)C=O,328.0
C(=C/c1nc2ccccc2o1)\c1ccc(Cn2cc(COc3cc(Cn4cc(-c5ccc(N(c6ccc(-c7cn(Cc8cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12o%11)cc%10)nn9)cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12o%11)cc%10)nn9)c8)nn7)cc6)c6ccc(-c7cn(Cc8cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12o%11)cc%10)nn9)cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12o%11)cc%10)nn9)c8)nn7)cc6)cc5)nn4)cc(OCc4cn(Cc5ccc(/C=C/c6nc7ccccc7o6)cc5)nn4)c3)nn2)cc1,CN(C)C=O,327.0
C(=C/c1nc2ccccc2s1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,C1CCOC1,386.0
C(=C/c1nc2ccccc2s1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,CC#N,380.0
C(=C/c1nc2ccccc2s1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,CO,375.0
C(=C/c1nc2ccccc2s1)\c1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1,ClCCl,384.0
C(=C/c1nc2ccccc2s1)\c1ccc(Cn2cc(-c3ccc(N(c4ccc(-c5cn(Cc6ccc(/C=C/c7nc8ccccc8s7)cc6)nn5)cc4)c4ccc(-c5cn(Cc6ccc(/C=C/c7nc8ccccc8s7)cc6)nn5)cc4)cc3)nn2)cc1,CN(C)C=O,345.0
C(=C/c1nc2ccccc2s1)\c1ccc(Cn2cc(COc3cc(Cn4cc(-c5ccc(N(c6ccc(-c7cn(Cc8cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12s%11)cc%10)nn9)cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12s%11)cc%10)nn9)c8)nn7)cc6)c6ccc(-c7cn(Cc8cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12s%11)cc%10)nn9)cc(OCc9cn(Cc%10ccc(/C=C/c%11nc%12ccccc%12s%11)cc%10)nn9)c8)nn7)cc6)cc5)nn4)cc(OCc4cn(Cc5ccc(/C=C/c6nc7ccccc7s6)cc5)nn4)c3)nn2)cc1,CN(C)C=O,339.0
C(=C/c1nc2ccccc2s1)\c1ccccc1,C1CCCCC1,340.0
C(=C/c1nc2ccccc2s1)\c1ccccc1,CO,340.0
C(=C/c1ncc(-c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)o1)\c1cccc(N2CCCC2)c1,ClCCl,353.0
C(=C/c1ncc(-c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)o1)\c1cccc(N2CCN(c3ccccc3)CC2)c1,ClCCl,355.0
C(=C/c1ncc2ccccc2n1)\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,382.0
C(=C/c1ncc2ccccc2n1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,400.0
C(=C/c1ncc2ccccc2n1)\c1ccc(N2CCCCC2)cc1,ClCCl,385.0
C(=C/c1nccc2ccccc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,402.0
C(=C/c1nccc2ccccc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,402.0
C(=C/c1ncccn1)\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,373.0
C(=C/c1ncnc2ccccc12)\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,402.0
C(=C/c1ncnc2ccccc12)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,429.0
C(=C/c1ncnc2ccccc12)\c1ccc(N2CCCCC2)cc1,ClCCl,425.0
C(=C1c2ccccc2-c2ccccc21)c1ccc(-c2ccc(C=C3c4ccccc4-c4ccccc43)cc2)cc1,C1CCOC1,366.0
C(=C1c2ccccc2-c2ccccc21)c1ccc(C=C2c3ccccc3-c3ccccc32)cc1,C1CCOC1,365.0
C(=C1c2ccccc2CCc2ccccc21)c1ccc(-c2cc(-c3ccc(C=C4c5ccccc5CCc5ccccc54)cc3)cc(-c3ccc(C=C4c5ccccc5CCc5ccccc54)cc3)c2)cc1,C1CCOC1,318.0
C(=C1c2ccccc2CCc2ccccc21)c1ccc(-c2ccc(C=C3c4ccccc4CCc4ccccc43)cc2)cc1,C1CCOC1,335.0
C(=CC=C1C=C(c2ccccc2)OC(c2ccccc2)=C1)C=Cc1ccncn1,ClCCl,469.0
C(=CC=Cc1ccccc1)C=Cc1ccccc1,C1CCCCC1,372.0
C(=CP(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1,ClCCl,445.0
C(=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,370.0
C(=C\c1ccc2ccc3cccc4ccc1c2c34)\c1ccc(/C=C/c2c3ccccc3cc3ccccc23)cc1,CCCCCC,385.0
C(=C\c1ccc2ccc3cccc4ccc1c2c34)\c1ccc(/C=C/c2c3ccccc3cc3ccccc23)cc1,CS(C)=O,390.0
C(=C\c1ccc2ccc3cccc4ccc1c2c34)\c1ccc(/C=C/c2c3ccccc3cc3ccccc23)cc1,ClCCl,388.0
C(=Cc1c2ccccc2cc2ccccc12)c1ccc(-c2ccnc(-c3cccc(-c4ccccc4)n3)c2)cc1,CN(C)C=O,498.0
C(=Cc1c2ccccc2cc2ccccc12)c1ccccc1,CC1CCCCC1,385.0
C(=Cc1cc(C=CC=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)ncn1)C=C1C=C(c2ccccc2)OC(c2ccccc2)=C1,ClCCl,503.0
C(=Cc1ccc(-c2ccc(C=CSC=C(c3ccccc3)c3ccccc3)cc2)cc1)SC=C(c1ccccc1)c1ccccc1,ClCCl,365.0
C(=Cc1ccc(-c2cnc3c(ccc4cc(-c5ccc(C=Cc6cccs6)s5)cnc43)c2)s1)c1cccs1,ClCCl,505.0
C(=Cc1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccc(-c2nc3ccccc3s2)cc1,CO,371.0
C(=Cc1ccc(-n2ccnc2)cc1)c1ccc(-c2ccnc(-c3cccc(-c4ccccc4)n3)c2)cc1,CN(C)C=O,426.0
C(=Cc1ccc(-n2cncn2)cc1)c1ccc(-c2ccnc(-c3cccc(-c4ccccc4)n3)c2)cc1,CCO,416.0
C(=Cc1ccc(N(c2ccc(C=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(C=Cc3ccc(C=Cc4ccc(N(c5ccc(C=Cc6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)c5ccc(C=Cc6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4)c4nsnc34)cc2)cc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,425.0
C(=Cc1ccc(N(c2ccccc2)c2ccc(-c3nc4ccccc4nc3-c3ccc(N(c4ccccc4)c4ccc(C=Cc5ccccc5)cc4)cc3)cc2)cc1)c1ccccc1,CC#N,368.0
C(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,C1CCOC1,296.0
C(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(-c2ccnc(-c3cccc(-c4ccccc4)n3)c2)cc1,CN(C)C=O,557.0
C(=Cc1ccccc1)c1ccccc1,C1CCOC1,412.0
C(=Cc1ccccc1C=Cc1ccccc1)c1ccccc1,c1ccccc1,368.0
C(=Cc1ccn2cc(-c3ccccc3)nc2c1)c1ccccc1,O=C(O)C(F)(F)F,410.0
C(=Cc1ccnc(-n2ccnc2)n1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,410.0
C(=Cc1ccncn1)C=C1C=C(c2ccccc2)OC(c2ccccc2)=C1,ClCCl,444.0
C(=Cc1cnccn1)C=C1C=C(c2ccccc2)OC(c2ccccc2)=C1,ClCCl,440.0
C(=Cc1nc2ccccc2[nH]1)c1ccncc1,CCO,341.0
C(=Cc1nc2ccccc2s1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,CO,343.0
C(=N/c1ccc(-c2cn3nc(-c4cccs4)sc3n2)cc1)\c1c2ccccc2cc2ccccc12,ClC(Cl)Cl,380.0
C(=N/c1ccc(-c2cn3nc(-c4cccs4)sc3n2)cc1)\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,390.0
C(=N/c1ccc(-c2cn3nc(-c4cccs4)sc3n2)cc1)\c1ccc2ccc3cccc4ccc1c2c34,ClC(Cl)Cl,403.0
C(=NNc1ncnc2nc[nH]c12)c1ccccc1,CCO,268.0
C(S/C=C/c1ccc(-c2ccc(/C=C/SC=C(c3ccccc3)c3ccccc3)cc2)cc1)=C(c1ccccc1)c1ccccc1,ClCCl,365.0
C(S/C=C/c1ccc(-c2ccc(/C=C/SC=C3CCCC3)cc2)cc1)=C1CCCC1,ClCCl,352.0
C(S/C=C/c1ccc(-c2ccc(/C=C/SC=C3CCCCC3)cc2)cc1)=C1CCCCC1,ClCCl,351.0
C(S/C=C/c1ccc(-c2ccc(/C=C/SC=C3CCCCCC3)cc2)cc1)=C1CCCCCC1,ClCCl,353.0
C(S/C=C/c1ccc(/C=C/SC=C(c2ccccc2)c2ccccc2)cc1)=C(c1ccccc1)c1ccccc1,ClCCl,366.0
C(S/C=C/c1ccc(/C=C/SC=C2CCCC2)cc1)=C1CCCC1,ClCCl,350.0
C(S/C=C/c1ccc(/C=C/SC=C2CCCCCC2)cc1)=C1CCCCCC1,ClCCl,353.0
C(\c1ccccc1)=c1\o/c(=C\c2ccc(N3CCCC3)cc2)c2ccccc12,ClCCl,414.0
C(\c1ccccc1)=c1\o/c(=C\c2ccc(N3CCCCC3)cc2)c2ccccc12,ClCCl,397.0
C(\c1ccccc1)=c1\o/c(=C\c2ccc(N3CCOCC3)cc2)c2ccccc12,ClCCl,390.0
C/C(=C\N(c1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1,Cc1ccccc1,425.0
C/C(=C\c1ccc(C)cc1)c1nc2ccccc2o1,C1CCCCC1,315.0
C/C(=C\c1ccc(C)cc1)c1nc2ccccc2o1,CO,315.0
C/C(=C\c1ccc(C)cc1)c1nc2ccccc2s1,C1CCCCC1,320.0
C/C(=C\c1ccc(C)cc1)c1nc2ccccc2s1,CO,325.0
C/C(=C\c1ccc(Cl)cc1)c1nc2ccccc2o1,C1CCCCC1,320.0
C/C(=C\c1ccc(Cl)cc1)c1nc2ccccc2o1,CO,320.0
C/C(=C\c1ccc(Cl)cc1)c1nc2ccccc2s1,C1CCCCC1,320.0
C/C(=C\c1ccc(Cl)cc1)c1nc2ccccc2s1,CO,320.0
C/C(=C\c1ccccc1)c1nc2ccccc2o1,C1CCCCC1,315.0
C/C(=C\c1ccccc1)c1nc2ccccc2o1,CO,315.0
C/C(=N\Nc1ccc(C#N)cc1)c1cccc(/C(C)=N/Nc2ccc(C#N)cc2)c1,CC#N,355.0
C/C(=N\Nc1ccc(C#N)cc1)c1cccc(/C(C)=N/Nc2ccc(C#N)cc2)c1,CCCCCC,359.0
C/C(=N\Nc1ccc(C#N)cc1)c1cccc(/C(C)=N/Nc2ccc(C#N)cc2)c1,CO,346.0
C/C(=N\Nc1ccc(C#N)cc1)c1cccc(/C(C)=N/Nc2ccc(C#N)cc2)c1,CS(C)=O,366.0
C/C(=N\Nc1ccc(C#N)cc1)c1cccc(/C(C)=N/Nc2ccc(C#N)cc2)c1,ClC(Cl)Cl,353.0
C/C=C(\C=C/C(/C=C/c1cc2ccc(N(CC)CCCCCC(=O)O)cc2oc1=O)=[NH+]/CCCS(=O)(=O)[O-])S(=O)(=O)[O-],CCO,521.0
C/C=C/C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,429.0
C/C=C/C1=N/C(=C\c2ccc(O)cc2)C(=O)N1C,ClC(Cl)Cl,400.0
C/C=C/C1=N/C(=C\c2ccc(O)cc2)C(=O)N1C,O,401.0
C/C=C/C1=N/C(=C\c2ccc([O-])cc2)C(=O)N1C,O,460.0
C/C=C/C=C/C1=N/C(=C\c2ccc(O)cc2)C(=O)N1C,ClC(Cl)Cl,425.0
C/C=C/C=C/C1=N/C(=C\c2ccc(O)cc2)C(=O)N1C,O,421.0
C/C=C/C=C/C1=N/C(=C\c2ccc([O-])cc2)C(=O)N1C,O,482.0
C/C=C/c1cc(OC)cc(OC)c1,CCCCCC,296.0
C/C=C/c1ccc(OC)cc1,CCCCCC,305.0
C/C=C/c1cccc(OC)c1,CCCCCC,293.0
C1#Cc2ccccc2OCc2cccc(c2)COc2ccccc21,ClCCl,309.0
C1#Cc2ccccc2OCc2ccccc2COc2ccccc21,ClCCl,313.0
C1=C(/C=C/c2ccccc2)B(c2ccccc2)N2CCN3B(c4ccccc4)C(/C=C/c4ccccc4)=Cc4ccc1c2c43,ClCCl,400.0
C1=C(c2ccc(-c3cccs3)s2)CCC(c2ccccc2)C1,C1CCOC1,342.0
C1=C(c2ccc(-c3cccs3)s2)CCC(c2ccccc2)C1,CC#N,341.0
C1=C(c2ccc(-c3cccs3)s2)CCC(c2ccccc2)C1,CCCCCC,344.0
C1=C(c2ccc(-c3cccs3)s2)CCC(c2ccccc2)C1,CCO,341.0
C1=C(c2ccc(-c3cccs3)s2)CCC(c2ccccc2)C1,OCCOCCO,346.0
C1=C(c2ccc(-c3cccs3)s2)CCC(c2ccccc2)C1,c1ccncc1,347.0
C1=C(c2ccc(-c3cccs3)s2)CCCC1,C1CCOC1,341.0
C1=C(c2ccc(-c3cccs3)s2)CCCC1,CC#N,342.0
C1=C(c2ccc(-c3cccs3)s2)CCCC1,CCCCCC,341.0
C1=C(c2ccc(-c3cccs3)s2)CCCC1,CCO,344.5
C1=C(c2ccc(-c3cccs3)s2)CCCC1,OCCOCCO,345.0
C1=C(c2ccc(-c3cccs3)s2)CCCC1,c1ccncc1,345.0
C1=C(c2ccccc2)B(c2ccccc2)N2CCN3B(c4ccccc4)C(c4ccccc4)=Cc4ccc1c2c43,ClCCl,348.0
C1=C(c2ccccc2)B(c2ccccc2)Nc2c1ccc1ccccc21,C1CCCCC1,365.0
C1=C(c2ccccc2)C(c2ccccc2)=CC1c1ccccc1,C1CCOC1,290.0
C1=C(c2ccccc2)C(c2ccccc2)C(c2ccccc2)=C1,C1CCOC1,304.0
C1=C(c2ccccc2)C2=Nc3c(-c4ccccc4)cc4n3[B-]3(Oc5ccccc5C1=[N+]23)Oc1ccccc1-4,Cc1ccccc1,728.0
C1=C(c2ccccc2)C=C(c2ccccc2)/C1=C/c1cccc(Oc2ccccc2)c1,C1CCOC1,440.0
C1=C(c2ccccc2)C=C(c2ccccc2)/C1=C/c1ccccc1,C1CCOC1,438.0
C1=C(c2ccccc2)C=C(c2ccccc2)SC1(Cc1ccccc1)c1ccccc1,CCO,349.0
C1=C(c2ccccc2)Cc2ccccc21,CCOC(C)=O,380.0
C1=C(c2ccccc2)S[C@]23C1=C(c1ccccc1)[C@H](c1ccccc12)c1ccccc13,ClCCl,378.0
C1=C(c2ccccc2)[Si](c2ccccc2)(c2ccccc2)c2ccccc21,ClCCl,338.0
C1=C(c2ccccn2)[Si](c2ccccc2)(c2ccccc2)c2ccccc21,ClCCl,339.0
C1=C/C2=C(\c3ccccc3)c3c[nH]c(c3)/C(c3ccccc3)=C3/C=CC(=N3)/C(c3ccccc3)=c3/cc/c([nH]3)=C(\c3ccccc3)C1=N2,CC(=O)N(C)C,699.0
C1=C2B(Nc3ccc(-c4ccc5ccc6cccc7ccc4c5c67)cc31)c1cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc1C(c1ccccc1)=C2c1ccccc1,ClCCl,402.0
C1=C2B(Nc3ccc(N(c4ccccc4)c4ccccc4)cc31)c1cc(N(c3ccccc3)c3ccccc3)ccc1C(c1ccccc1)=C2c1ccccc1,CCCCCC,443.0
C1=C2B(Nc3ccc(N(c4ccccc4)c4ccccc4)cc31)c1cc(N(c3ccccc3)c3ccccc3)ccc1C(c1ccccc1)=C2c1ccccc1,Cc1ccccc1,443.0
C1=C2B(Nc3ccc(N(c4ccccc4)c4ccccc4)cc31)c1cc(N(c3ccccc3)c3ccccc3)ccc1C(c1ccccc1)=C2c1ccccc1,ClCCl,443.0
C1=C2B(Nc3ccccc31)OB1Nc3ccccc3C=C1C(c1ccccc1)=C2c1ccccc1,ClCCl,413.0
C1=C2B(Nc3ccccc31)c1cc(-c3ccc4c(c3)C=C3B(N4)c4cc(-c5ccc6c(c5)B5Nc7ccccc7C=C5C(c5ccccc5)=C6c5ccccc5)ccc4C(c4ccccc4)=C3c3ccccc3)ccc1C(c1ccccc1)=C2c1ccccc1,ClCCl,407.0
C1=C2B(Nc3ccccc31)c1cc(N(c3ccccc3)c3ccccc3)ccc1C(c1ccccc1)=C2c1ccccc1,ClCCl,432.0
C1=C2B(c3ccccc3C(c3ccccc3)=C2c2ccccc2)N(Cc2ccccc2)c2ccccc21,ClCCl,391.0
C1=C2C3=C(C4=[N+]2[B-]2(Oc5ccccc54)Oc4ccccc4-c4c5c(c1n42)C1CCC5CC1)C1CCC3CC1,ClCCl,626.0
C1=C2c3cc4ccccc4cc3C3=[N+]2[B-]2(Oc4ccccc43)Oc3ccccc3-c3c4cc5ccccc5cc4c1n32,C1CCOC1,830.0
C1=CB2C=Cc3c(ccc4ccccc34)N2C=C1,C1CCCCC1,334.0
C1=CB2C=Cc3cc4ccccc4cc3N2C=C1,ClCCl,372.0
C1=CC(=NC2c3cccnc3-c3ncccc32)C(OCC(COC2C=CC=CC2=NC2c3cccnc3-c3ncccc32)(COC2C=CC=CC2=NC2c3cccnc3-c3ncccc32)COC2C=CC=CC2=NC2c3cccnc3-c3ncccc32)C=C1,ClC(Cl)Cl,432.0
C1=CC([Fe]C2C=Cc3ccccc32)c2ccccc21,ClCCl,422.0
C1=CC(c2ccc(C=Cc3ccc(-c4ccnc(-c5cccc(-c6ccccc6)n5)c4)cc3)cc2)C2=Nc3ccccc3C2=C1,ClCCl,469.0
C1=CC(c2ccccc2)(c2ccccc2)Oc2ccc3ccccc3c21,Cc1ccccc1,425.0
C1=CC2=CC=C3C(c4oc5cccc6[n+]5c4-c4ccccc4-6)=CC=C4C=CC(=C1)C2C43,ClCCl,485.0
C1=CC2=CC=CC3C=c4c(cc5cccc6cccc4c65)C(=C1)C23,ClCCl,543.0
C1=CC2=Nc3cccc[n+]3CN2C=C1,CO,412.0
C1=CC2C=c3c(cc4cccc5cc6ccccc6c3c45)C3=c4ccccc4=CC(=C1)C32,ClCCl,592.0
C1=CC=C2C=CC=CC(=C1)C2,ClC(Cl)Cl,660.0
C1=CCC2C=c3ccccc3=C(c3oc4cccc5[n+]4c3-c3ccccc3-5)C2=C1,ClCCl,411.0
C1=CCCC=C1,C=CCCCCCC,636.0
C1=CN2B(C=Cc3c2ccc2ccccc32)C(N2CCOCC2)=C1,C1CCCCC1,319.0
C1=CN2B(C=Cc3c2ccc2ccccc32)C(c2ccccc2)=C1,C1CCCCC1,323.0
C1=CN2B(C=Cc3ccccc32)C(N2CCOCC2)=C1,C1CCCCC1,319.0
C1=CN2B(C=Cc3ccccc32)C(c2ccccc2)=C1,C1CCCCC1,316.0
C1=CN2C[n+]3ccc4ccccc4c3N=C2c2ccccc21,CO,453.0
C1=CN2C[n+]3cccc(OCc4ccccc4)c3N=C2C(OCc2ccccc2)=C1,CO,450.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,C1CCOC1,476.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,C1COCCO1,479.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,CC#N,463.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,CC(C)=O,467.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,CC1CCCCC1,493.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,CCCCCC,491.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,CCOCC,479.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,CN(C)C=O,464.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,CO,463.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,Cc1ccccc1,493.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,ClC(Cl)(Cl)Cl,499.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,ClC(Cl)Cl,483.0
C1=CSC(=C2SC=C(/C=C/C=C/C=C/C3=CSC(=C4SC=CS4)S3)S2)S1,ClCCl,482.0
C1=Cc2c(ccc3ccccc23)NB1c1ccccc1,C1CCCCC1,356.0
C1=Cc2c(ccc3ccccc23)OC1,Cc1ccccc1,345.0
C1=Cc2cc3ccccc3cc2N2C=Cc3cc4ccccc4cc3B12,ClCCl,416.0
C1=Cc2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2C2(c3cc(N(c4ccccc4)c4cccc5ccccc45)ccc31)c1ccccc1-c1ccccc12,ClCCl,403.0
C1=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2C2(c3cc(N(c4ccccc4)c4ccccc4)ccc31)c1ccccc1-c1ccccc12,ClCCl,406.0
C1=Cc2ccc3c4c2N(CCN4B(c2ccccc2)C(/C=C/c2ccccc2)=C3)B1c1ccccc1,ClCCl,369.0
C1=Cc2ccc3c4c2N(CCN4B(c2ccccc2)C(c2ccccc2)=C3)B1c1ccccc1,ClCCl,333.0
C1=Cc2ccc3c4c2N(CCN4B(c2ccccc2)C=C3)B1c1ccccc1,ClCCl,307.0
C1=Cc2ccc3ccccc3c2N(c2ccccc2)B1c1ccccc1,C1CCCCC1,364.0
C1=Cc2ccc3ccccc3c2NB1c1ccccc1,C1CCCCC1,360.0
C1=Cc2cccc3cccc1c23,C1CCCCC1,325.0
C1=Cc2ccccc2C(=Cc2ccc(-c3cc(-c4ccc(C=C5c6ccccc6C=Cc6ccccc65)cc4)c(-c4ccc(C=C5c6ccccc6C=Cc6ccccc65)cc4)cc3-c3ccc(C=C4c5ccccc5C=Cc5ccccc54)cc3)cc2)c2ccccc21,C1CCOC1,324.0
C1=Cc2ccccc2C(=Cc2ccc(-c3ccc(C=C4c5ccccc5-c5ccccc54)cc3)cc2)c2ccccc21,C1CCOC1,357.0
C1=Cc2ccccc2C(=Cc2ccc(-c3ccc(C=C4c5ccccc5C=Cc5ccccc54)cc3)cc2)c2ccccc21,C1CCOC1,339.0
C1=Cc2ccccc2C(=Cc2ccc(C=C3c4ccccc4-c4ccccc43)cc2)c2ccccc21,C1CCOC1,360.0
C1=Cc2ccccc2Cc2ccccc21,CC#N,285.0
C1=Cc2ccccc2Cc2ccccc21,CO,285.0
C1=Cc2ccccc2N2C=Cc3cc4ccccc4cc3B12,ClCCl,390.0
C1=Cc2nc1c(-c1ccccc1)c1ccc([nH]1)c(-c1ccccc1)c1cc(c(-c3ccccc3)c3ccc([nH]3)c2-c2ccccc2)N=C1,ClCCl,726.0
C1=Cc2nc1c(-c1ccccc1)c1ccc([nH]1)c(-c1ccccc1)c1nc(c(-c3ccccc3)c3ccc([nH]3)c2-c2ccccc2)C=C1,CC(=O)N(C)C,646.0
C1=Cc2nc1c(-c1ccccc1)c1ccc([nH]1)c(-c1ccccc1)c1nc(c(-c3ccccc3)c3ccc([nH]3)c2-c2ccccc2)C=C1,ClCCl,646.0
C1=Cc2nc1c(-c1ccco1)c1ccc([nH]1)c(-c1ccco1)c1nc(c(-c3ccco3)c3ccc([nH]3)c2-c2ccco2)C=C1,ClCCl,433.0
C1=Cc2nc1c(-c1ccco1)c1ccc(s1)c(-c1ccco1)c1nc(c(-c3ccco3)c3ccc(s3)c2-c2ccco2)C=C1,ClCCl,458.0
C1=Cc2nc1c(-c1cccs1)c1ccc([nH]1)c(-c1cccs1)c1nc(c(-c3cccs3)c3ccc([nH]3)c2-c2cccs2)C=C1,CN(C)C=O,661.0
C1=Cc2nc1c(-c1cccs1)c1ccc([nH]1)c(-c1cccs1)c1nc(c(-c3cccs3)c3ccc([nH]3)c2-c2cccs2)C=C1,ClCCl,426.0
C1=Nc2cccc3cccc(c23)N1,CC#N,329.0
C1=Nc2cccc3cccc(c23)N1,CO,329.0
C1=Nc2cccc3cccc(c23)N1,CS(C)=O,333.0
C1=Nc2cccc3cccc(c23)N1,Cc1ccccc1,331.0
C1=[N+](c2ccccc2)[B-](c2ccccc2)(c2ccccc2)n2cccc21,C1CCOC1,382.7160493827161
C1=[N+](c2ccccc2)[B-]2(Oc3c1ccc1c4c(ccc31)C=[N+](c1ccccc1)[B-]1(O4)c3ccccc3Oc3ccccc31)c1ccccc1Oc1ccccc12,Cc1ccccc1,549.0
C1=[N+](c2ccccc2)[B-]2(Oc3c1ccc1c4c(ccc31)C=[N+](c1ccccc1)[B-]1(O4)c3ccccc3Oc3ccccc31)c1ccccc1Oc1ccccc12,ClCCl,545.0
C1CC2CC3CCC(N3)C3CCC(CC4CCC(CC1N2)N4)N3,ClCCl,656.0
C1CO1,C1COCCO1,416.0
C1COCCO1,CCO,460.0
C=C,CCCCCCC,162.0
C=C(C)C(=O)Nc1csc(-c2ccc(C(=O)c3ccc(Cl)cc3)cc2)c1,ClC(Cl)Cl,256.0
C=C(C)C(=O)Nc1csc(-c2ccc(C(=O)c3ccccc3)cc2)c1,ClC(Cl)Cl,251.0
C=C(C)C(=O)OCCOc1ccc(-c2nnc(-c3ccccc3)s2)cc1,CN(C)C=O,367.0
C=C(C)C(CN1C(=O)c2cccc3cccc(c23)C1=O)OO,CCO,332.0
C=C(COC(=O)c1ccc(C(=O)c2ccccc2)cc1)C(=O)OCC,CN(C)C=O,255.0
C=C(COc1ccc(C(=O)c2ccccc2)cc1)C(=O)O,CN(C)C=O,289.0
C=C(O)c1c2ccccc2cc2ccccc12,CC#N,369.0
C=C(c1ccccc1)c1nn(-c2ccccc2)nc1-c1ccccc1,CO,296.0
C=C1Cn2c3ccccc3c3cc(C(=O)OC)nc(c32)-c2nc3ccccc3n21,ClC(Cl)Cl,392.79
C=C=C/C(=C\C=C)c1c(C)c(/C=C/C=C2/N(CCCS(=O)(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCC(=O)O)[o+]c2cc(N(CC)CCCS(=O)(=O)[O-])ccc12,CCO,709.0
C=CB1C=Cc2ccc3ccccc3c2N1,C1CCCCC1,355.0
C=CC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,429.0
C=CC(=O)Oc1ccc2cc(C=C)c(=O)oc2c1,CC#N,320.0
C=CC(=O)c1ccc2cc(N(C)C)ccc2c1,CO,391.0
C=CC(C)(Cl)C(Cl)C=CC(C=O)=CCl,CN(C)C=O,743.0
C=CC(C=C=Cc1ccccc1)(c1ccc(C#N)cc1)N(C)C,CC#N,422.0
C=CC1CN2CCC1CC2[C@@H](OCc1ccccc1)c1ccnc2ccc(O)cc12,C1CCOC1,338.0
C=CC1CN2CCC1CC2[C@@H](OCc1ccccc1)c1ccnc2ccc(O)cc12,CC#N,335.0
C=CC1CN2CCC1CC2[C@@H](OCc1ccccc1)c1ccnc2ccc(O)cc12,CCCC#N,337.0
C=CC1CN2CCC1CC2[C@@H](OCc1ccccc1)c1ccnc2ccc(O)cc12,Cc1ccccc1,335.0
C=CC1CN2CCC1CC2[C@@H](OCc1ccccc1)c1ccnc2ccc(O)cc12,ClCCl,334.0
C=CC1CN2CCC1CC2[C@H](O)c1ccnc2ccc(OC)cc12,O,347.0
C=CCCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,428.0
C=CCCc1c2ccccc2cc2ccccc12,CC#N,370.0
C=CCN1c2ccc(OC)cc2C(C)(C)C12C=Cc1c(c(-c3nc(-c4ccccc4)c(-c4ccccc4)o3)cc3cc(OC)ccc13)O2,Cc1ccccc1,310.0
C=CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCOC(C)=O,405.0
C=CCNC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CO,396.0
C=CCNS(=O)(=O)c1ccc2c(c1)C(=O)/C(=C1\Sc3ccc(S(=O)(=O)NCC=C)cc3C1=O)S2,CN(C)C=O,542.0
C=CCNS(=O)(=O)c1ccc2c(c1)C(=O)/C(=C1\Sc3ccc(S(=O)(=O)NCC=C)cc3C1=O)S2,CS(C)=O,544.0
C=CCNc1cc2c3c(c(NC=C)cc4c3c1C(=O)N(CC=C)C4=O)C(=O)N(CC=C)C2=O,Cc1ccccc1,601.0
C=CCNc1ccc2c(ccc3oc4cc(=[N+](C)C)ccc-4nc32)c1,CC#N,597.0
C=CCNc1ccc2c(ccc3oc4cc(=[N+](C)C)ccc-4nc32)c1,CCO,601.0
C=CCNc1ccc2c(ccc3oc4cc(=[N+](C)C)ccc-4nc32)c1,ClCCl,610.0
C=CCNc1ccc2c(ccc3oc4cc(=[N+](C)C)ccc-4nc32)c1,O,579.0
C=CCNc1ccc2c3c(cccc13)C(=O)N(c1ccc3nn(-c4ccccc4O)nc3c1)C2=O,ClC(Cl)Cl,424.0
C=CCNc1ccc2ccc3oc4cc(=O)ccc-4nc3c2c1,CC#N,537.0
C=CCNc1ccc2ccc3oc4cc(=O)ccc-4nc3c2c1,CCO,531.0
C=CCNc1ccc2ccc3oc4cc(=O)ccc-4nc3c2c1,ClCCl,539.0
C=CCNc1ccc2ccc3oc4cc(=O)ccc-4nc3c2c1,O,522.0
C=CCNc1ccc2ccc3oc4cc(=[N+]5CCCC5)ccc-4nc3c2c1,CC#N,576.0
C=CCNc1ccc2ccc3oc4cc(=[N+]5CCCC5)ccc-4nc3c2c1,CCO,570.0
C=CCNc1ccc2ccc3oc4cc(=[N+]5CCCC5)ccc-4nc3c2c1,ClCCl,588.0
C=CCNc1ccc2ccc3oc4cc(=[N+]5CCCC5)ccc-4nc3c2c1,O,556.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,C1CCOC1,470.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,C1COCCO1,462.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,CC#N,476.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,CN(C)C=O,486.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,Cc1ccccc1,467.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,ClC(Cl)Cl,479.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,ClCCCl,482.0
C=CCOC(=O)C(C#N)=C1C=C(/C=C/c2ccc(N(C)C)cc2)OC(/C=C/c2ccc(N(C)C)cc2)=C1,ClCCl,481.0
C=CCOc1ccc(-c2nc3cc(C(NC(=O)OC(C)(C)C)C(=O)OC)ccc3o2)cc1,CC#N,309.0
C=CCOc1ccc(-c2nc3cc(C(NC(=O)OC(C)(C)C)C(=O)OC)ccc3o2)cc1,CC1CCCCC1,324.0
C=CCOc1ccc(-c2nc3cc(C(NC(=O)OC(C)(C)C)C(=O)OC)ccc3o2)cc1,CO,309.0
C=CCOc1ccccc1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,560.0
C=CCOc1nnc(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)nn1,ClCCl,526.0
C=CCOc1nnc(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)nn1,OCC(F)(F)F,512.0
C=CCOc1nnc(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)nn1,ClCCl,526.0
C=CCOc1nnc(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)nn1,OCC(F)(F)F,512.0
C=CC[NH+]=C1c2cccn2[B-](F)(F)n2cccc21,CCOC(C)=O,405.0
C=CCn1c2ccccc2c2cc(C(=O)OC)nc(-c3nc4ccccc4[nH]3)c21,ClC(Cl)Cl,382.31
C=CCn1c2ccccc2c2cc(C(=O)OC)nc(-c3nc4ccccc4s3)c21,ClC(Cl)Cl,382.02
C=COC(=O)c1c2ccccc2cc2ccccc12,CC#N,365.0
C=C[C@H]1CN2CC[C@H]1C[C@H]2[C@H](O)c1ccnc2ccc(OC)cc12,CO,334.0
C=C[Si](c1c2ccccc2cc2ccccc12)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,ClC(Cl)Cl,404.0
C=C[Si]1(C)c2ccccc2-c2cc3c(cc21)-c1ccccc1[Si]3(C)C=C,ClCCl,325.0
C=Cc1c(C)c2cc3nc(c4c5[nH]c(cc6nc(cc1[nH]2)C(C)=C6CC)c(C)c5C(=O)C4)[C@@H](CCC(=O)OC)[C@@H]3C,ClCCl,667.0
C=Cc1c2ccccc2cc2ccccc12,CC#N,371.0
C=Cc1cc(OC)cc(OC)c1,C1CCCCC1,299.0
C=Cc1cc2ccc(N(CC)CC)cc2oc1=O,CC#N,400.0
C=Cc1cc2ccc(OC)cc2oc1=O,CC#N,333.0
C=Cc1cc2ccccc2oc1=O,CC#N,326.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,C1COCCO1,342.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CC#N,338.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CC(=O)N(C)C,343.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CCCCCCCCCCO,345.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CCCCCCCCO,344.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CCCCCCO,344.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CCCCO,342.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CCO,341.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,CS(C)=O,343.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,Cc1ccccc1,346.0
C=Cc1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C=C)cc7)s6)o5)cc4)o3)s2)cc1,ClC(Cl)Cl,346.0
C=Cc1ccc(-c2ccc(C(C#N)=Cc3ccc(-c4csc(C=C(C#N)c5ccccc5)c4)cc3)cc2)cc1,C1CCOC1,366.0
C=Cc1ccc(N(c2ccccc2)c2ccc(/C=C/C=C3/SC(=S)N(CC(=O)O)C3=O)cc2)cc1,CO,474.0
C=Cc1ccc(N(c2ccccc2)c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)cc2)cc1,CO,461.0
C=Cc1ccc(N(c2ccccc2)c2ccc(C=C(C#N)C(=O)O)cc2)cc1,CO,403.0
C=Cc1ccc(OC)c(OC)c1,C1CCCCC1,309.0
C=Cc1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,C1COCCO1,350.0
C=Cc1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,CC#N,350.0
C=Cc1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,CCO,349.0
C=Cc1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,CS(C)=O,354.0
C=Cc1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,Cc1ccccc1,346.0
C=Cc1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,ClC(Cl)Cl,350.0
C=Cc1ccc2c(c1)C(C)(C)c1cc(N(C)C)ccc1-2,O,353.0
C=Cc1ccnc(-c2cc(-c3cc(C=C)ccn3)cc(-c3cc(C=C)ccn3)c2)c1,CC1COC(=O)O1,312.0
C=Cc1ccncc1,CS(C)=O,325.0
C=c1c2c(-c3ccc(-n4c5c(c6ccccc64)CCC5)cc3)n(CC)c(=C)c2c(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)n1CC,CCO,436.0
C=c1c2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n(CC)c(=C)c2c(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)n1CC,CCO,455.0
CB1C=Cc2ccc3ccccc3c2N1,C1CCCCC1,352.0
CB1C=Cc2ccc3ccccc3c2N1c1ccccc1,C1CCCCC1,359.0
CB1Nc2cccc3c2-n2c1ccc2B(C)N3,ClCCl,309.0
CC#CCCCCC,CCCCCC,178.0
CC#C[B-]1(C#CC)n2c3[n+](c4ccccc42)[B-](C#CC)(C#CC)n2c(cc(I)c2CC)C3=C2C=C(I)C(CC)=[N+]21,ClCCl,594.0
CC(=C(C#Cc1ccccc1)C#Cc1ccccc1)c1ccc(C(C)=C(C#Cc2ccccc2)C#Cc2ccccc2)cc1,ClC(Cl)Cl,360.0
CC(=C1C=C(c2ccccc2)OC(c2ccccc2)=C1)c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,ClCCl,433.0
CC(=Cc1ccc(C=C(C#N)C(=O)O)cc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,305.0
CC(=NNC(=Cc1ccc2ccccc2n1)C(C)(C)C)c1ccc(Br)cc1,CCO,442.0
CC(=O)/C(=C(/C)O)c1ccc(C#Cc2ccc3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)C)cc7)c(c7cccc2c73)c64)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C5=O)cc1,CN(C)C=O,538.0
CC(=O)/C(=C(/C)O)c1ccc(C#Cc2ccc3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7cccc(C(C)(C)C)c7)c(c7cccc2c37)c64)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C5=O)cc1,CN(C)C=O,538.0
CC(=O)C(=O)c1ccccc1,CC#N,450.0
CC(=O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O,CC(C)=O,323.0
CC(=O)CC(=O)c1ccc(-c2nc3ccccc3n2C)o1,Cc1ccccc1,382.0
CC(=O)CC(=O)c1ccc(-c2nc3ccccc3o2)o1,Cc1ccccc1,403.0
CC(=O)CC(=O)c1ccc(-c2nc3ccccc3s2)o1,Cc1ccccc1,394.0
CC(=O)N(C)c1ncnc2cc(-c3ccc(N(C)C)cc3)n3nc(-c4ccc(N(C)C)cc4)cc3c12,CCOCC,392.0
CC(=O)N(C)c1ncnc2cc(-c3ccc(N(C)C)cc3)n3nc(-c4ccc(N(C)C)cc4)cc3c12,ClCCl,404.0
CC(=O)N(C)c1ncnc2cc(-c3ccc(N(C)C)cc3)n3nc(-c4ccccc4)cc3c12,ClCCl,403.0
CC(=O)N(C)c1ncnc2cc(-c3ccccc3)n3nc(-c4ccc(N(C)C)cc4)cc3c12,ClCCl,393.0
CC(=O)N1CCN(CCCOc2ccc(C=CC(=O)c3nnn(-c4ccnc5cc(Cl)ccc45)c3C)cc2)CC1,CO,238.0
CC(=O)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12,C1CCCCC1,350.0
CC(=O)NC(Cc1ccc(O)cc1)C(=O)O[Si]1(OC(=O)C(Cc2ccc(O)cc2)NC(C)=O)n2c3c4ccccc4c2/N=C2\N=C(/N=c4/c5ccccc5/c(n41)=N/C1=N/C(=N\3)c3ccccc31)c1ccccc12,CN(C)C=O,684.0
CC(=O)NC1=CC(=O)C(=O)c2ccccc21,CCO,265.0
CC(=O)NCC(=O)NC1=CC(=O)C(=O)c2ccccc21,CCO,278.0
CC(=O)Nc1cc(N(CCOC(C)=O)CCOC(C)=O)ccc1N=Nc1ccc([N+](=O)[O-])cc1Cl,CO,507.0
CC(=O)Nc1cc2ccc3cccc4ccc(c1)c2c34,CC#N,334.0
CC(=O)Nc1cc2ccc3cccc4ccc(c1)c2c34,CCCCOCCCC,336.0
CC(=O)Nc1cc2ccc3cccc4ccc(c1)c2c34,CO,334.0
CC(=O)Nc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,565.0
CC(=O)Nc1ccc(C2=C/C(=C\c3ccc(C#N)cc3)C(=O)N2)cc1,C1COCCO1,456.0
CC(=O)Nc1ccc(C2=N/C(=C\c3ccc(C#N)cc3)C(=O)O2)cc1,C1COCCO1,389.0
CC(=O)Nc1ccc(N=Nc2ccc(O)c3ncccc23)cc1,CS(C)=O,417.0
CC(=O)Nc1ccc(N=Nc2nc3ccc([N+](=O)[O-])cc3s2)cc1,CO,419.0
CC(=O)Nc1ccc(N=Nc2nc3ccccc3s2)cc1,CO,385.0
CC(=O)Nc1ccc(O)cc1,C1CCOC1,293.0
CC(=O)Nc1ccc(O)cc1,CC#N,290.0
CC(=O)Nc1ccc(O)cc1,CCCCO,290.0
CC(=O)Nc1ccc(O)cc1,CO,290.0
CC(=O)Nc1ccc(O)cc1,CS(C)=O,293.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,C1CCOC1,435.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,CC(C)=O,425.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,CCOC(C)=O,434.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,CO,423.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,CS(C)=O,428.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,Cc1ccccc1,437.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,ClCCl,435.0
CC(=O)Nc1ccc(S(=O)(=O)O)c(/N=N/c2c(O)c3ccccc3n(C)c2=O)c1,O,417.0
CC(=O)Nc1ccc2c(c1)CCCc1c-2[o+]c2c(c1-c1ccccc1)CCCc1cc(NC(C)=O)ccc1-2,CCO,509.0
CC(=O)Nc1ccc2c(c1)c(=O)c1cc(NC(C)=O)ccc1n2CCCCCC(=O)O,O,430.0
CC(=O)Nc1ccc2c(c1)c(=O)c1ccccc1n2CCCCCC(=O)O,O,398.0
CC(=O)Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,C1COCCO1,447.0
CC(=O)Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CCCCOCCCC,453.0
CC(=O)Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CCOC(C)=O,451.0
CC(=O)Nc1ccc2ccc3cccc4ccc1c2c34,CC#N,339.0
CC(=O)Nc1ccc2ccc3cccc4ccc1c2c34,CCCCOCCCC,341.0
CC(=O)Nc1ccc2ccc3cccc4ccc1c2c34,CO,338.0
CC(=O)Nc1cccc2c1C#Cc1c(cccc1C(=O)N(C)C)OCCCO2,CC#N,315.0
CC(=O)Nc1cccc2c1C#Cc1c(cccc1C(=O)N(C)C)OCCCO2,ClCCl,318.0
CC(=O)Nc1ccccc1C(=O)OC1CC(C)CCC1C(C)C,C1CCCCC1,315.0
CC(=O)Nc1ccccc1C(=O)OC1CC(C)CCC1C(C)C,CC#N,310.0
CC(=O)Nc1ccccc1C(=O)OC1CC(C)CCC1C(C)C,CCO,310.0
CC(=O)Nc1ccccc1C(=O)OC1CC(C)CCC1C(C)C,CO,307.0
CC(=O)Nc1ccccc1C(=O)OC1CC(C)CCC1C(C)C,Cc1ccccc1,313.0
CC(=O)Nc1ccccc1C(=O)OC1CC(C)CCC1C(C)C,ClC(Cl)Cl,312.0
CC(=O)Nc1ccccc1C(=O)OC1CC(C)CCC1C(C)C,ClCCl,310.0
CC(=O)Nc1ccccc1N=Nc1nc2ccc([N+](=O)[O-])cc2s1,CO,353.0
CC(=O)Nc1ccccc1N=Nc1nc2ccccc2s1,CO,335.0
CC(=O)O,CS(C)=O,267.0
CC(=O)OCCN(CCC#N)c1ccc(N=Nc2nc(-c3ccc(Cl)cc3Cl)cs2)cc1,CN(C)C=O,540.0
CC(=O)OCCN1C(=O)c2cccc3c(Oc4ccc(C=O)cc4)ccc(c23)C1=O,ClC(Cl)Cl,353.0
CC(=O)OCCN1C(=O)c2cccc3c(Oc4ccccc4C)ccc(c23)C1=O,ClC(Cl)Cl,352.0
CC(=O)OCCOCCN1C(=O)c2cc(NCCOCCO)c3c4c(cc(NCCOCCO)c(c24)C1=O)C(=O)N(CCOCCOC(C)=O)C3=O,CO,604.0
CC(=O)OCCOCCN1C(=O)c2cc(NCCOCCO)c3c4c(cc(NCCOCCO)c(c24)C1=O)C(=O)N(CCOCCOC(C)=O)C3=O,ClC(Cl)Cl,610.0
CC(=O)OCCOCCN1C(=O)c2cc(NCCOCCO)c3c4c(cc(NCCOCCO)c(c24)C1=O)C(=O)N(CCOCCOC(C)=O)C3=O,O,622.0
CC(=O)OCOC(=O)CN(CC(=O)OCOC(C)=O)Cc1cc2c(cc1OC(C)=O)Oc1cc(OC(C)=O)c(CN(CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O)cc1C21OC(=O)c2ccccc21,O,494.0
CC(=O)OCOC(=O)CN(CC(=O)OCOC(C)=O)c1ccccc1OCCOc1cc(NC(=O)c2ccc3c(c2)C(=O)OC32c3cc(Cl)c(OC(C)=O)cc3Oc3cc(OC(C)=O)c(Cl)cc32)ccc1N(CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O,O,506.5
CC(=O)OCOC(=O)CN(CC(=O)OCOC(C)=O)c1ccccc1OCCOc1cc(NC(=S)Nc2ccc(-c3c4ccc(N(C)C)cc4[o+]c4cc(N(C)C)ccc34)c(C(=O)[O-])c2)ccc1N(CC(=O)OCOC(C)=O)CC(=O)OCOC(C)=O,O,549.0
CC(=O)OC[C@@H]1O[C@H](N2C=CC3=Nc4nc(C)[n+](C)cc4CN3C2=O)[C@@H](O)[C@H]1O,CC#N,386.0
CC(=O)OC[C@@H]1O[C@H](N2C=CC3=Nc4nc(C)[n+](C)cc4CN3C2=O)[C@@H](O)[C@H]1O,CCO,388.0
CC(=O)OC[C@@H]1O[C@H](N2C=CC3=Nc4nc(C)[n+](C)cc4CN3C2=O)[C@@H](O)[C@H]1O,O,382.0
CC(=O)OC[C@H]1O[C@@H](OCC#Cc2ccc(C3=C4C(C)=CC(/C=C/c5ccc(N(C)C)cc5)=[N+]4[B-](F)(F)n4c(/C=C/c5ccc(N(C)C)cc5)cc(C)c43)cc2)[C@H](OC(C)=O)C(OC(C)=O)[C@@H]1OC(C)=O,CC#N,701.0
CC(=O)OC[C@H]1O[C@@H](OCC#Cc2ccc(C3=C4C(C)=CC(/C=C/c5ccc([N+](C)(C)C)cc5)=[N+]4[B-](F)(F)n4c(/C=C/c5ccc([N+](C)(C)C)cc5)cc(C)c43)cc2)[C@H](OC(C)=O)C(OC(C)=O)[C@@H]1OC(C)=O,CC#N,618.0
CC(=O)OC[C@H]1O[C@@H]([C@@H]2C=C(Br)C(=S)NC2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,ClC(Cl)(Cl)Cl,440.0
CC(=O)OC[C@H]1O[C@@H]([C@@H]2C=C(Cl)C(=S)NC2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,ClC(Cl)(Cl)Cl,440.0
CC(=O)OC[C@H]1O[C@@H]([C@@H]2C=C(F)C(=S)NC2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,ClC(Cl)(Cl)Cl,432.0
CC(=O)OC[C@H]1O[C@@H]([C@@H]2C=C(I)C(=S)NC2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,ClC(Cl)(Cl)Cl,440.0
CC(=O)OC[C@H]1O[C@@H]([C@@H]2C=CC(=S)NC2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O,ClC(Cl)(Cl)Cl,420.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/C=C/c2ccccc2)=CC(/C=C/C=C/c2ccccc2)=[O+]1,C1CCOC1,468.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/C=C/c2ccccc2)=CC(/C=C/C=C/c2ccccc2)=[O+]1,CC#N,472.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/C=C/c2ccccc2)=CC(/C=C/C=C/c2ccccc2)=[O+]1,CC(C)=O,468.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/C=C/c2ccccc2)=CC(/C=C/C=C/c2ccccc2)=[O+]1,CS(C)=O,478.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/C=C/c2ccccc2)=CC(/C=C/C=C/c2ccccc2)=[O+]1,Cc1ccccc1,470.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/C=C/c2ccccc2)=CC(/C=C/C=C/c2ccccc2)=[O+]1,ClC(Cl)Cl,474.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/C=C/c2ccccc2)=CC(/C=C/C=C/c2ccccc2)=[O+]1,ClCCl,474.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/c2ccccc2)=CC(/C=C/c2ccccc2)=[O+]1,C1CCOC1,422.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/c2ccccc2)=CC(/C=C/c2ccccc2)=[O+]1,CC#N,422.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/c2ccccc2)=CC(/C=C/c2ccccc2)=[O+]1,CC(C)=O,422.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/c2ccccc2)=CC(/C=C/c2ccccc2)=[O+]1,CS(C)=O,428.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/c2ccccc2)=CC(/C=C/c2ccccc2)=[O+]1,Cc1ccccc1,424.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/c2ccccc2)=CC(/C=C/c2ccccc2)=[O+]1,ClC(Cl)Cl,426.0
CC(=O)O[B-]1(OC(C)=O)OC(/C=C/c2ccccc2)=CC(/C=C/c2ccccc2)=[O+]1,ClCCl,424.0
CC(=O)Oc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,566.0
CC(=O)Oc1ccc(/C=C/c2nc3c(c(=O)n(C)c(=O)n3C)n2C)cc1,ClCCl,356.0
CC(=O)[B-]1(C(C)=O)OC(C)=CC(c2ccc3ccccc3c2)=[O+]1,CC#N,380.0
CC(=O)[B-]1(C(C)=O)OC(C)=CC(c2ccc3ccccc3c2)=[O+]1,ClC(Cl)(Cl)Cl,380.0
CC(=O)[B-]1(C(C)=O)OC(c2ccc3ccccc3c2)=CC(c2ccc3ccccc3c2)=[O+]1,CC#N,420.0
CC(=O)[B-]1(C(C)=O)OC(c2ccc3ccccc3c2)=CC(c2ccc3ccccc3c2)=[O+]1,ClC(Cl)(Cl)Cl,415.0
CC(=O)[B-]1(C(C)=O)OC(c2ccccc2)=CC(c2ccc3ccccc3c2)=[O+]1,CC#N,400.0
CC(=O)[B-]1(C(C)=O)OC(c2ccccc2)=CC(c2ccc3ccccc3c2)=[O+]1,ClC(Cl)(Cl)Cl,400.0
CC(=O)[O-],CCO,634.0
CC(=O)[O-],O,210.0
CC(=O)c1c(N[C@@H](CC(C)C)C(=O)O)c2ccc(N(C)C)cc2oc1=O,ClCCl,372.0
CC(=O)c1c(N[C@@H](CS)C(=O)O)c2ccc(N(C)C)cc2oc1=O,ClCCl,372.0
CC(=O)c1c(N[C@@H](Cc2ccccc2)C(=O)O)c2ccc(N(C)C)cc2oc1=O,ClCCl,374.0
CC(=O)c1c2c(c(-c3ccccc3)c3cc(N(C)C)ccc13)C(=O)CC2,ClCCl,427.0
CC(=O)c1c2c(c(C(C)=O)c3c1OC(CC(=O)O)O3)OCO2,CC#N,433.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,C1CCCCC1,363.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,C1CCOC1,370.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,C1COCCO1,370.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,CC#N,370.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,CCO,374.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,CS(C)=O,374.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,Cc1ccccc1,368.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,ClC(Cl)Cl,373.0
CC(=O)c1c2c(cc3cc(N(C)C)ccc13)CCC2,ClCCl,372.0
CC(=O)c1c2c(cc3ccc(N4CCOCC4)cc13)CCC2,ClCCl,355.0
CC(=O)c1c2ccccc2n2c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c12,CC#N,410.0
CC(=O)c1c2ccccc2n2c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c12,CS(C)=O,413.0
CC(=O)c1c2ccccc2n2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c12,CC#N,408.0
CC(=O)c1c2ccccc2n2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c12,CS(C)=O,415.0
CC(=O)c1cc(=O)n(C)c2cc(-c3ccc(N(C)C)cc3)sc12,CC#N,440.0
CC(=O)c1cc(=O)n(C)c2cc(-c3ccc(N(C)C)cc3)sc12,ClCCl,448.0
CC(=O)c1cc2c(cc1F)NC(C)(C)CC2=O,CC#N,352.0
CC(=O)c1cc2cc3c4c(c2oc1=O)CCCN4CCC3,CCO,445.0
CC(=O)c1cc2cc3ccccc3nc2nc1C,CC(C)=O,372.0
CC(=O)c1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,CC#N,401.0
CC(=O)c1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,ClCCl,407.0
CC(=O)c1ccc(-c2c3cc([N+](=O)[O-])ccc3nn2C)s1,CC#N,385.0
CC(=O)c1ccc(-c2c3cc([N+](=O)[O-])ccc3nn2C)s1,ClCCl,385.0
CC(=O)c1ccc(-c2cc(C)[o+]c(C)c2)cc1,ClCCl,336.0
CC(=O)c1ccc(-c2cc3c(ccc4sccc43)s2)cc1,ClCCl,350.0
CC(=O)c1ccc(-c2ccc3c(c2)C(=O)c2cc(-c4ccc(C(C)=O)cc4)ccc2-3)cc1,C1CCOC1,343.0
CC(=O)c1ccc(-c2cccc3cnc(-c4ccccc4)n23)cc1,ClCCl,358.0
CC(=O)c1ccc(-c2cccc3ncc(-c4ccccc4)n23)cc1,ClCCl,358.0
CC(=O)c1ccc(-c2cnc3nn4ccccc4c3n2)cc1,C1CCOC1,400.0
CC(=O)c1ccc(-c2scc3c2OCCO3)cc1,ClCCl,335.0
CC(=O)c1ccc(C#Cc2ccc(-c3cc(N(C)C)c4ccccc4c3)cc2)cc1,ClCCl,330.0
CC(=O)c1ccc(C#Cc2ccc3c(N(C)C)cc(-c4ccccc4)cc3c2)cc1,ClCCl,319.0
CC(=O)c1ccc(N)cc1,Clc1ccccc1,435.0
CC(=O)c1ccc(N=NC=C2N(C)c3ccccc3C2(C)C)cc1,C1CCOC1,461.0
CC(=O)c1ccc(N=Nc2ccc(O)c3ncccc23)cc1,CS(C)=O,417.0
CC(=O)c1ccc(O)c(O)c1,C1CCOC1,303.0
CC(=O)c1ccc([N+]([O-])=Cc2ccc3c(c2)Sc2ccccc2N3C)cc1,ClCCl,312.0
CC(=O)c1ccc2c(-c3ccc(Br)cc3)c3c(n2c1)C(=O)N(CCNC(=O)OC(C)(C)C)C3,ClCCl,347.0
CC(=O)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CC#N,344.0
CC(=O)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CCO,346.0
CC(=O)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CCOC(C)=O,347.0
CC(=O)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CO,344.0
CC(=O)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,ClC(Cl)Cl,345.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,C1CCOC1,451.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,CC#N,440.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,CC(C)O,452.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,CCO,451.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,CN(C)C=O,452.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,CO,447.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,CS(C)=O,456.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,O,460.0
CC(=O)c1ccc2ccc3c(NCCC(=O)NCCCCCCc4nc5c(=O)[nH]c(N)nc5n4[C@H]4C[C@H](O)[C@@H](CO)O4)ccc4ccc1c2c43,OCC(O)CO,464.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,C1CCOC1,384.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,CC#N,382.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,CCCCCC,384.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,CCO,383.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,CN(C)C=O,384.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,CO,385.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,Cc1ccccc1,387.0
CC(=O)c1ccc2ccc3cccc4ccc1c2c34,ClCCl,385.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C(C)=O)o3)c2c1,CC#N,368.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C(C)=O)o3)c2c1,ClCCl,371.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C)o3)c2c1,CC#N,362.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C)o3)c2c1,ClCCl,365.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C)s3)c2c1,CC#N,348.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C)s3)c2c1,ClCCl,351.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C=O)o3)c2c1,CC#N,372.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C=O)o3)c2c1,ClCCl,376.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C=O)s3)c2c1,CC#N,357.0
CC(=O)c1ccc2nn(C)c(-c3ccc(C=O)s3)c2c1,ClCCl,358.0
CC(=O)c1cccc([N+]([O-])=Cc2ccc3c(c2)Sc2ccccc2N3C)c1,ClCCl,314.0
CC(=O)c1cccn2c3c(c(-c4ccc(Br)cc4)c12)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,387.0
CC(=O)c1ccn2c3c(c(-c4cc[n+](C)cc4)c2c1)CN(C)C3=O,O,429.0
CC(=O)c1ccn2c3c(c(-c4ccc(Br)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,405.0
CC(=O)c1ccn2c3c(c(-c4ccc(C#N)c(C#N)c4)c2c1)CN(CCCNC(=O)OC(C)(C)C)C3=O,CO,402.0
CC(=O)c1ccn2c3c(c(-c4ccc(C#N)cc4)c2c1)CN(CCCNC(=O)OC(C)(C)C)C3=O,CO,398.0
CC(=O)c1ccn2c3c(c(-c4ccc(C#N)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,407.0
CC(=O)c1ccn2c3c(c(-c4ccc(C(F)(F)F)cc4)c2c1)CN(CCCNC(=O)OC(C)(C)C)C3=O,CO,405.0
CC(=O)c1ccn2c3c(c(-c4ccc(C)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,408.0
CC(=O)c1ccn2c3c(c(-c4ccc(F)cc4)c2c1)CN(CCCNC(=O)OC(C)(C)C)C3=O,CO,402.0
CC(=O)c1ccn2c3c(c(-c4ccc(N(C)C)cc4)c2c1)CN(C(C)CO)C3=O,ClCCl,440.0
CC(=O)c1ccn2c3c(c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,428.0
CC(=O)c1ccn2c3c(c(-c4ccc(N)cc4)c2c1)CN(CCCNC(=O)OC(C)(C)C)C3=O,CO,417.0
CC(=O)c1ccn2c3c(c(-c4ccc(O)cc4)c2c1)CN(CCCNC(=O)OC(C)(C)C)C3=O,CO,413.0
CC(=O)c1ccn2c3c(c(-c4cccc(Br)c4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,403.0
CC(=O)c1ccn2c3c(c(-c4cccc(C#N)c4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,400.0
CC(=O)c1ccn2c3c(c(-c4cccc(N(C)C)c4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,408.0
CC(=O)c1ccn2c3c(c(-c4ccccc4)c2c1)CN(C(C)CO)C3=O,ClCCl,403.0
CC(=O)c1ccn2c3c(c(-c4ccccc4)c2c1)CN(CCCNC(=O)OC(C)(C)C)C3=O,CO,403.0
CC(=O)c1ccn2c3c(c(-c4ccccc4Br)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,391.0
CC(=O)c1ccn2c3c(c(-c4ccccc4C#N)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,392.0
CC(=O)c1ccn2c3c(c(-c4ccccc4N(C)C)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,410.0
CC(=O)c1ccn2c3c(c(-c4cccs4)c2c1)CN(C(C)CO)C3=O,ClCCl,349.0
CC(=O)c1ccn2c3c(c(/C=C/c4cc[n+](C)cc4)c2c1)CN(C)C3=O,O,459.0
CC(=O)c1ccn2c3c(c(C)c2c1)CN(C(C)CO)C3=O,ClCCl,396.0
CC(=O)c1nc(-c2ccc(C)cc2)oc1C,CC#N,271.0
CC(=O)c1nc(-c2ccc(C)cc2)oc1C,CCCCCC,272.0
CC(=O)c1nc(-c2ccc(C)cc2)oc1C,CCO,271.0
CC(=O)c1nc(-c2ccc(C)cc2)oc1C,CCOC(C)=O,273.0
CC(=O)c1nc(-c2ccc(C)cc2)oc1C,CCOCC,271.0
CC(=O)c1nc(-c2ccc(C)cc2)oc1C,ClCCl,271.0
CC(=O)c1nc(-c2ccc(N(C)C)cc2)oc1C,CC#N,318.0
CC(=O)c1nc(-c2ccc(N(C)C)cc2)oc1C,CCCCCC,315.0
CC(=O)c1nc(-c2ccc(N(C)C)cc2)oc1C,CCO,321.0
CC(=O)c1nc(-c2ccc(N(C)C)cc2)oc1C,CCOC(C)=O,320.0
CC(=O)c1nc(-c2ccc(N(C)C)cc2)oc1C,CCOCC,316.0
CC(=O)c1nc(-c2ccc(N(C)C)cc2)oc1C,ClCCl,317.0
CC(=O)n1cc(/C=C/c2ccc([N+](=O)[O-])cc2)c2ccccc21,CC#N,377.0
CC(=O)n1cc(/C=C/c2ccc([N+](=O)[O-])cc2)c2ccccc21,CCCCCCC,363.0
CC(=O)n1cc(/C=C/c2ccc([N+](=O)[O-])cc2)c2ccccc21,CO,374.0
CC(=O)n1cc(/C=C/c2ccc([N+](=O)[O-])cc2)c2ccccc21,O,381.0
CC(C(=O)O)c1ccc2c(N=Nc3c([N+](=O)[O-])cc(C(=O)O)cc3[N+](=O)[O-])c(O)ccc2c1,CCOC(C)=O,470.0
CC(C)(C(=O)c1ccc(N2c3ccccc3Oc3ccccc32)cc1)C(=O)c1ccc(N2c3ccccc3Oc3ccccc32)cc1,Cc1ccccc1,416.0
CC(C)(C)/C=C/C1=[N+]2C(=C(c3c4ccccc4cc4ccccc34)c3ccc(/C=C/C(C)(C)C)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,582.0
CC(C)(C)C#Cc1cc2c(C#CC(C)(C)C)c(C#CC(C)(C)C)c3cc(C#CC(C)(C)C)cc4c(C#CC(C)(C)C)c(C#CC(C)(C)C)c(c1)c2c34,ClCCl,383.0
CC(C)(C)C#Cc1ccc2c3cccc4cccc(c5cccc1c52)c43,C1CCCCC1,455.0
CC(C)(C)C(=Cc1ccc2ccccc2n1)NN=Cc1cccc([N+](=O)[O-])c1,CCO,430.0
CC(C)(C)C(Cc1ccc2ccccc2n1)=NN=C(Cc1ccc2ccccc2n1)C(C)(C)C,CCO,317.0
CC(C)(C)C1=CC(=C(c2ccc(C(=O)O)cc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)C=C(C(C)(C)C)C1=O,CO,472.0
CC(C)(C)C1=CC(=C(c2ccc(C=C(C#N)C(=O)O)cc2)c2ccc(N(c3ccccc3)c3ccccc3)cc2)C=C(C(C)(C)C)C1=O,CO,482.0
CC(C)(C)C1=CC(=C(c2ccc(C=C(C#N)C(=O)O)s2)c2ccc(/C=C(/C#N)C(=O)O)s2)C=C(C(C)(C)C)O1,ClCCl,534.0
CC(C)(C)C1=CC(=C(c2ccc(C=C(C#N)C(=O)O)s2)c2ccc(C(C)(C)C)s2)C=C(C(C)(C)C)O1,ClCCl,552.0
CC(C)(C)C1=CC(=C(c2ccc(C=O)s2)c2ccc(C=C(C#N)C(=O)O)s2)C=C(C(C)(C)C)O1,ClCCl,534.0
CC(C)(C)C1=CC(=C(c2cccs2)c2ccc(C=C(C#N)C(=O)O)s2)C=C(C(C)(C)C)O1,ClCCl,547.0
CC(C)(C)C1=CC(=CC=CC=CC=C2c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3-c3c2cc([N+](=O)[O-])cc3[N+](=O)[O-])C=C(C(C)(C)C)O1,Cc1ccccc1,779.0
CC(C)(C)C1=CC(=CC=Cc2cccnn2)C=C(C(C)(C)C)O1,ClCCl,410.0
CC(C)(C)C1=CC(=CC=Cc2ccncn2)C=C(C(C)(C)C)O1,ClCCl,429.0
CC(C)(C)C1=CC(=CC=Cc2cnc3ccccc3n2)C=C(C(C)(C)C)O1,ClCCl,470.0
CC(C)(C)C1=CC(=CC=Cc2cnccn2)C=C(C(C)(C)C)O1,ClCCl,427.0
CC(C)(C)C1=CC(=Cc2cc3sc(/C=C(\C#N)C(=O)O)cc3s2)C=C(C(C)(C)C)O1,ClCCl,562.0
CC(C)(C)C1=CC(=Cc2ccc(C=C(C#N)C(=O)O)o2)C=C(C(C)(C)C)O1,ClC(Cl)Cl,538.0
CC(C)(C)C1=CC(=Cc2ccc(C=C(C#N)C(=O)O)s2)C=C(C(C)(C)C)O1,ClC(Cl)Cl,553.0
CC(C)(C)C1=CC(=Cc2cnc(C=C(C#N)C(=O)O)s2)C=C(C(C)(C)C)O1,ClC(Cl)Cl,573.0
CC(C)(C)C1=CC(=Cc2ncc(C=C(C#N)C(=O)O)s2)C=C(C(C)(C)C)O1,ClC(Cl)Cl,531.0
CC(C)(C)C1=CC2=C3C(=CC=C4C=CC(c5cc6c7cc(-c8ccc9ccc%10cc(C(C)(C)C)cc%11ccc8c9c%10%11)ccc7c(-c7ccc8ccc9cc(C(C)(C)C)cc%10ccc7c8c9%10)cc6c6cc(-c7ccc8ccc9cc(C(C)(C)C)cc%10ccc7c8c9%10)ccc56)=C(C=C2)C43)C1,ClCCl,349.0
CC(C)(C)C1CC(/C=C(\C#N)C(=O)O)=C2OC(c3ccccc3)=CC(c3ccccc3)=C2C1,ClCCl,548.0
CC(C)(C)C1CC(/C=C(\C#N)C(=O)O)=C2SC(c3ccccc3)=CC(c3ccccc3)=C2C1,ClCCl,554.0
CC(C)(C)C1CC(/C=C/C=C(\C#N)C(=O)O)=C2OC(c3ccccc3)=CC(c3ccccc3)=C2C1,ClCCl,588.0
CC(C)(C)C1CC(/C=C/C=C(\C#N)C(=O)O)=C2SC(c3ccccc3)=CC(c3ccccc3)=C2C1,ClCCl,597.0
CC(C)(C)C1CCC(=CS/C=C/c2ccc(-c3ccc(/C=C/SC=C4CCC(C(C)(C)C)CC4)cc3)cc2)CC1,ClCCl,350.0
CC(C)(C)C1CCC(=CS/C=C/c2ccc(/C=C/SC=C3CCC(C(C)(C)C)CC3)cc2)CC1,ClCCl,351.0
CC(C)(C)C1CCC(=CSC=Cc2ccc(-c3ccc(C=CSC=C4CCC(C(C)(C)C)CC4)cc3)cc2)CC1,ClCCl,350.0
CC(C)(C)C1Nc2c(Br)cc(Br)cc2C(=O)N1Cc1ccccc1,CC#N,360.0
CC(C)(C)C1Nc2c(Br)cc(Br)cc2C(=O)N1Cc1ccccc1,CCCCCCCCCCCCCCCC,351.0
CC(C)(C)C1Nc2c(Br)cc(Br)cc2C(=O)N1Cc1ccccc1,CO,368.0
CC(C)(C)C1Nc2c(Br)cc(Br)cc2C(=O)N1Cc1ccccc1,ClC(Cl)Cl,359.0
CC(C)(C)C1Nc2c(Br)cc(Br)cc2C(=O)N1Cc1ccccc1,c1ccccc1,356.0
CC(C)(C)C1Nc2c(Cl)cc(Cl)cc2C(=O)N1Cc1ccccc1,CC#N,360.0
CC(C)(C)C1Nc2c(Cl)cc(Cl)cc2C(=O)N1Cc1ccccc1,CCCCCCCCCCCCCCCC,350.0
CC(C)(C)C1Nc2c(Cl)cc(Cl)cc2C(=O)N1Cc1ccccc1,CO,367.0
CC(C)(C)C1Nc2c(Cl)cc(Cl)cc2C(=O)N1Cc1ccccc1,ClC(Cl)Cl,357.0
CC(C)(C)C1Nc2c(Cl)cc(Cl)cc2C(=O)N1Cc1ccccc1,c1ccccc1,355.0
CC(C)(C)C1Nc2ccccc2C(=O)N1Cc1ccccc1,CC#N,344.0
CC(C)(C)C1Nc2ccccc2C(=O)N1Cc1ccccc1,CCCCCCCCCCCCCCCC,333.0
CC(C)(C)C1Nc2ccccc2C(=O)N1Cc1ccccc1,CO,353.0
CC(C)(C)C1Nc2ccccc2C(=O)N1Cc1ccccc1,ClC(Cl)Cl,341.0
CC(C)(C)C1Nc2ccccc2C(=O)N1Cc1ccccc1,c1ccccc1,339.0
CC(C)(C)C1Nc2ccccc2C(=O)N1c1ccccc1,CC#N,348.0
CC(C)(C)C1Nc2ccccc2C(=O)N1c1ccccc1,CCCCCCCCCCCCCCCC,337.0
CC(C)(C)C1Nc2ccccc2C(=O)N1c1ccccc1,CO,356.0
CC(C)(C)C1Nc2ccccc2C(=O)N1c1ccccc1,ClC(Cl)Cl,344.0
CC(C)(C)C1Nc2ccccc2C(=O)N1c1ccccc1,c1ccccc1,343.0
CC(C)(C)CC(C)(C)c1ccc(N(c2ccc(C(C)(C)CC(C)(C)C)cc2)c2ccc3c4c(Oc5ccc(-c6cc(-c7ccccc7)c(-c7ccccc7)c(-c7ccccc7)c6-c6ccccc6)cc5)cc5c6c(cc(Oc7ccc(-c8cc(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)cc7)c(c7cccc2c73)c64)C(=O)OC5=O)cc1,ClCCl,606.0
CC(C)(C)CC(C)(C)c1ccc(N(c2ccc(C(C)(C)CC(C)(C)C)cc2)c2ccc3c4c(Oc5ccccc5)cc5c6c(cc(Oc7ccccc7)c(c7cccc2c73)c64)C(=O)OC5=O)cc1,ClCCl,605.0
CC(C)(C)CC(C)(C)c1ccc(N(c2ccc(C(C)(C)CC(C)(C)C)cc2)c2ccc3c4c(Sc5ccccc5)cc5c6c(cc(Sc7ccccc7)c(c7cccc2c73)c64)C(=O)OC5=O)cc1,ClCCl,620.0
CC(C)(C)CC(C)(C)c1ccc(N(c2ccc(C(C)(C)CC(C)(C)C)cc2)c2ccc3c4ccc5c6c(ccc(c7cccc2c73)c64)C(=O)OC5=O)cc1,ClCCl,605.0
CC(C)(C)CC(C)(C)c1ccc(Oc2cc3c(cc2Oc2ccc(C(C)(C)CC(C)(C)C)cc2)/C2=N/c4c5cc(Oc6ccc(C(C)(C)CC(C)(C)C)cc6)c(Oc6ccc(C(C)(C)CC(C)(C)C)cc6)cc5c5n4[Zn]n4/c(c6cc(Oc7ccc(C(C)(C)CC(C)(C)C)cc7)c(Oc7ccc(C(C)(C)CC(C)(C)C)cc7)cc6/c4=N/C3=N2)=N\C2=N/C(=N\5)c3ccc(-c4ccc(C(=O)O)cc4)cc32)cc1,ClC(Cl)Cl,678.0
CC(C)(C)CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)CC(C)(C)C)cc5)c5c6ccc(N(c7ccccc7)c7ccccc7)c7cccc(c2c45)c76)C(=O)OC3=O)cc1,ClCCl,540.0
CC(C)(C)CC(C)(C)c1ccc(Oc2cc3c4c(ccc5c6c(Oc7ccc(C(C)(C)CC(C)(C)C)cc7)cc7c8c(ccc(c2c45)c86)C(=O)N(C2CCCCC2)C7=O)C(=O)OC3=O)cc1,C1CCOC1,510.0
CC(C)(C)N1C(=O)c2c(cc3ccc4cccc5ccc2c3c45)C1O,ClC(Cl)Cl,385.0
CC(C)(C)NC(=O)C(OC(=O)c1ccc(C2=C3C=CC(c4ccc([N+](=O)[O-])cc4)=[N+]3[B-](F)(F)n3cccc32)cc1)c1ccc(C(F)(F)F)cc1,C1CCOC1,538.5
CC(C)(C)NC(=O)C(OC(=O)c1ccc(C2=C3C=CC(c4ccc([N+](=O)[O-])cc4)=[N+]3[B-](F)(F)n3cccc32)cc1)c1ccc(C(F)(F)F)cc1,CC#N,533.5
CC(C)(C)NC(=O)C(OC(=O)c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1)c1ccc(C(F)(F)F)cc1,C1CCOC1,504.5
CC(C)(C)NC(=O)C(OC(=O)c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1)c1ccc([N+](=O)[O-])cc1,C1CCOC1,504.5
CC(C)(C)NC(=O)C(OC(=O)c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1)c1ccccc1,C1CCOC1,504.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)C1=CC2=C(c3ccc(C(F)(F)F)cc3)c3cccn3[B-](F)(F)[N+]2=C1,CCOC(C)=O,509.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)C1=CC2=C(c3ccccc3)c3cccn3[B-](F)(F)[N+]2=C1,CCOC(C)=O,505.0
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1ccc(C2=C3C=CC(c4ccc([N+](=O)[O-])cc4)=[N+]3[B-](F)(F)n3cccc32)cc1F,C1CCOC1,538.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1ccc(C2=C3C=CC(c4ccc([N+](=O)[O-])cc4)=[N+]3[B-](F)(F)n3cccc32)cc1F,CC#N,533.0
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,C1CCOC1,501.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,CCOC(C)=O,499.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1F,C1CCOC1,504.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)s1,CCOC(C)=O,509.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1cccc(C2=C3C=CC(c4ccc([N+](=O)[O-])cc4)=[N+]3[B-](F)(F)n3cccc32)c1,C1CCOC1,535.5
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1cccc(C2=C3C=CC(c4ccc([N+](=O)[O-])cc4)=[N+]3[B-](F)(F)n3cccc32)c1,CC#N,530.0
CC(C)(C)NC(=O)C(OC(=O)c1ccccc1)c1cccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c1,C1CCOC1,502.0
CC(C)(C)NC(=O)C(c1cc(Br)cc(Br)c1)N(C(=O)c1ccccc1)c1cccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c1,C1CCOC1,501.5
CC(C)(C)NC(=O)C(c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1)N(Cc1ccccc1)C(=O)c1ccccc1,C1CCOC1,501.5
CC(C)(C)NC(=O)c1c([Si](C)(C)C)cc2ccc3cccc4ccc1c2c34,ClC(Cl)Cl,382.0
CC(C)(C)NC(=O)c1cc2ccc3cccc4ccc(c1C(=O)NC(C)(C)C)c2c34,ClC(Cl)Cl,385.0
CC(C)(C)NC(=O)c1ccc(-c2cc3ccccc3o2)c2ccc3c4ccccc4c4ccccc4c3c12,ClCCl,364.0
CC(C)(C)NC(=O)c1ccc(-c2cc3ccccc3s2)c2ccc3c4ccccc4c4ccccc4c3c12,ClCCl,350.0
CC(C)(C)NC(=O)c1ccc(-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)c2ccc3c4ccc(F)cc4c4cc(F)ccc4c3c12,ClCCl,331.0
CC(C)(C)NC(=O)c1ccc(Br)c2ccc3c4ccc(F)cc4c4cc(F)ccc4c3c12,ClCCl,338.0
CC(C)(C)NC(=O)c1ccc(Br)c2ccc3c4ccccc4c4ccccc4c3c12,ClCCl,343.0
CC(C)(C)NC(=O)c1ccc(C(=O)NC(C)(C)C)c2c1c1c3ccc(Cl)cc3c3cc(Cl)ccc3c1c1c3ccc(Cl)cc3c3cc(Cl)ccc3c21,ClCCl,395.0
CC(C)(C)NC(=O)c1ccc(C(=O)NC(C)(C)C)c2c1c1c3ccccc3c3ccccc3c1c1c3ccccc3c3ccccc3c21,ClCCl,388.0
CC(C)(C)NC(=O)c1ccc(F)c2ccc3c4ccccc4c4ccccc4c3c12,ClCCl,334.0
CC(C)(C)NC(=O)c1ccc2ccc3cccc4c3c2c1c1c2ccccc2c2ccccc2c41,ClCCl,392.0
CC(C)(C)NC(=O)c1ccc2ccc3cccc4ccc1c2c34,ClC(Cl)Cl,377.0
CC(C)(C)NC(=O)c1cccc2ccc3c4cc(Cl)ccc4c4ccc(Cl)cc4c3c12,ClCCl,335.0
CC(C)(C)NC(=O)c1cccc2ccc3c4cc(F)ccc4c4ccc(F)cc4c3c12,ClCCl,334.0
CC(C)(C)NC(=O)c1cccc2ccc3c4ccc(Cl)cc4c4cc(Cl)ccc4c3c12,ClCCl,334.0
CC(C)(C)NC(=O)c1cccc2ccc3c4ccc(F)cc4c4cc(F)ccc4c3c12,ClCCl,329.0
CC(C)(C)NC(=O)c1cccc2ccc3c4ccccc4c4ccccc4c3c12,ClCCl,332.0
CC(C)(C)NC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,C1CCCCC1,428.0
CC(C)(C)NC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CC(C)=O,409.5
CC(C)(C)NC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCO,412.5
CC(C)(C)NC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCOC(C)=O,412.0
CC(C)(C)NC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CO,410.0
CC(C)(C)NC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,OCC(F)(F)F,406.0
CC(C)(C)NC1=CC2=c3cc(NC(C)(C)C)c4nc(C(F)(F)C(F)(F)C(F)(F)F)nc5c(NC(C)(C)C)cc(c3c54)C3=CC(NC(C)(C)C)=C4N=C(C(F)(F)C(F)(F)C(F)(F)F)N=C1C4C32,C1CCOC1,646.0
CC(C)(C)NS(=O)(=O)c1ccc2c(c1)C(=O)/C(=C1\Sc3ccc(S(=O)(=O)NC(C)(C)C)cc3C1=O)S2,C1COCCO1,538.0
CC(C)(C)NS(=O)(=O)c1ccc2c(c1)C(=O)/C(=C1\Sc3ccc(S(=O)(=O)NC(C)(C)C)cc3C1=O)S2,CN(C)C=O,543.0
CC(C)(C)NS(=O)(=O)c1ccc2c(c1)C(=O)/C(=C1\Sc3ccc(S(=O)(=O)NC(C)(C)C)cc3C1=O)S2,CS(C)=O,546.0
CC(C)(C)Nc1c(-c2cc(-c3ccc(Cl)cc3)n(-c3ccccc3)n2)nc2c(Br)cccn12,ClC(Cl)Cl,329.73
CC(C)(C)Nc1c(-c2cc(-c3ccc(Cl)cc3)n(-c3ccccc3)n2)nc2ccc(F)cn12,ClC(Cl)Cl,330.3
CC(C)(C)Nc1c(-c2cc(-c3ccc(Cl)cc3)n(-c3ccccc3)n2)nc2ccccn12,ClC(Cl)Cl,324.3
CC(C)(C)Nc1c(-c2cc(-c3ccc(Cl)cc3)n(-c3ccccc3)n2)nc2cnccn12,ClC(Cl)Cl,453.33
CC(C)(C)Nc1c(-c2nn(-c3ccccc3)c(-c3cccc(Br)c3)c2I)nc2ccccn12,ClC(Cl)Cl,320.0
CC(C)(C)Nc1cc(F)c(C(=O)c2cc(F)c(NC(C)(C)C)cc2F)cc1F,CCO,348.0
CC(C)(C)Nc1cc2oc3cc(NC(C)(C)C)c(F)cc3c(=O)c2cc1F,CCO,368.0
CC(C)(C)Nc1cc2sc3cc(NC(C)(C)C)c(F)cc3c(=O)c2cc1F,CCO,373.0
CC(C)(C)Nc1oc(C=Cc2ccccc2)c(C(=O)OC(C)(C)C)c1C(=O)OC(C)(C)C,CC#N,384.0
CC(C)(C)OC(=O)/C=C/C1=CC2=C(c3ccccc3)c3cccn3[B-](F)(F)[N+]2=C1,ClCCl,538.0
CC(C)(C)OC(=O)CN1CCN(c2ccc3c(-c4ccc(I)cc4)c4ccc(=[N+]5CCN(CC(=O)OC(C)(C)C)CC5)cc-4oc3c2)CC1,ClCCl,564.0
CC(C)(C)OC(=O)COc1ccc2c(c1)oc(=O)c1c(=O)oc3ccccc3c12,CS(C)=O,366.0
CC(C)(C)OC(=O)COc1ccc2c(c1)oc(=O)c1c(=O)oc3ccccc3c12,ClCCl,365.0
CC(C)(C)OC(=O)N1C(=O)C2=C(c3ccc(-c4ccc(C(C)(C)C)cc4)cc3)N(C(=O)OC(C)(C)C)C(=O)C2=C1c1ccc(-c2ccc(C(C)(C)C)cc2)cc1,ClCCl,463.0
CC(C)(C)OC(=O)N1C(=O)C2=C(c3ccc(-c4ccc(S(C)(=O)=O)cc4)cc3)N(C(=O)OC(C)(C)C)C(=O)C2=C1c1ccc(-c2ccc(S(C)(=O)=O)cc2)cc1,ClCCl,451.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(-c4ccc(I)cc4)c4ccc(=[N+]5CCN(C(=O)OC(C)(C)C)CC5)cc-4oc3c2)CC1,ClCCl,561.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(C)(C)c2cc(C=O)ccc2-3)CC1,C1COCCO1,363.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(C)(C)c2cc(C=O)ccc2-3)CC1,CC#N,362.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(C)(C)c2cc(C=O)ccc2-3)CC1,CCO,362.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(C)(C)c2cc(C=O)ccc2-3)CC1,CS(C)=O,375.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(C)(C)c2cc(C=O)ccc2-3)CC1,Cc1ccccc1,365.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(C)(C)c2cc(C=O)ccc2-3)CC1,ClC(Cl)Cl,366.0
CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(C)(C)c2cc(C=O)ccc2-3)CC1,O,377.0
CC(C)(C)OC(=O)NC(C(=O)OCc1ccc2c3cccc4cccc(c5cccc1c52)c43)c1c[nH]c2ccccc12,CCO,435.0
CC(C)(C)OC(=O)NC(Cc1ccccc1)C(=O)OCc1ccc2c3cccc4cccc(c5cccc1c52)c43,CCO,440.0
CC(C)(C)OC(=O)NCCCC(=O)OCc1ccc2c3cccc4cccc(c5cccc1c52)c43,CCO,439.0
CC(C)(C)OC(=O)NCCCN1Cc2c(-c3ccc(C#N)cc3)c3ccc4oc(-c5ccc(C#N)cc5)cc4n3c2C1=O,ClCCl,434.0
CC(C)(C)OC(=O)NCCCN1Cc2c(-c3ccc(C#N)cc3)c3ccc4oc(-c5ccccc5)cc4n3c2C1=O,ClCCl,413.0
CC(C)(C)OC(=O)NCCCN1Cc2c(-c3ccccc3)c3ccc4oc(-c5ccc(C#N)cc5)cc4n3c2C1=O,ClCCl,436.0
CC(C)(C)OC(=O)NCCCN1Cc2c(-c3ccccc3)c3ccc4occc4n3c2C1=O,ClCCl,372.0
CC(C)(C)OC(=O)NCCCN1Cc2cc3ccc4oc(-c5ccc(C#N)cc5)cc4n3c2C1=O,ClCCl,415.0
CC(C)(C)OC(=O)NCCCN1Cc2cc3ccc4occc4n3c2C1=O,ClCCl,355.0
CC(C)(C)OC(=O)NCCn1cc(COc2ccc(-c3cc(-c4ccccc4)c4n3[B-](F)(F)[N+]3=C(c5ccc(OCCCS(=O)(=O)[O-])cc5)C=C(c5ccccc5)C3=N4)cc2)nn1,O,692.0
CC(C)(C)OC(=O)N[C@@H](CCn1cc(COc2ccc(-c3cc(-c4ccccc4)c4n3[B-](F)(F)[N+]3=C(c5ccc(OCCCS(=O)(=O)[O-])cc5)C=C(c5ccccc5)C3=N4)cc2)nn1)C(=O)O,O,688.0
CC(C)(C)OC(=O)c1c(C=Cc2ccccc2)oc(NC2CCCCC2)c1C(=O)OC(C)(C)C,CC#N,384.0
CC(C)(C)OC(=O)c1ccc(OCCCCCCn2c(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2/C=C(\C#N)C(=O)O)cc1,ClCCl,486.0
CC(C)(C)[N+](=O)[O-],CCO,276.0
CC(C)(C)[Si](C)(C)C#Cc1c2c(=O)c3ccccc3c2c(C#C[Si](C)(C)C(C)(C)C)c2c(=O)c3ccccc3c12,ClC(Cl)Cl,526.0
CC(C)(C)[Si](C)(C)OC[C@H]1OC(n2ccc(=O)[nH]c2=O)=C(Br)[C@@H]1O[Si](C)(C)C(C)(C)C,CO,255.0
CC(C)(C)[Si](C)(C)OC[C@H]1OC(n2ccc(=O)[nH]c2=O)=C(Cc2ccccc2)[C@@H]1O[Si](C)(C)C(C)(C)C,CO,254.0
CC(C)(C)[Si](C)(C)OC[C@H]1OC(n2ccc(=O)[nH]c2=O)=C(Cl)[C@@H]1O[Si](C)(C)C(C)(C)C,CO,254.0
CC(C)(C)[Si](C)(C)OC[C@H]1OC(n2ccc(=O)[nH]c2=O)=C(F)[C@@H]1O[Si](C)(C)C(C)(C)C,CO,261.0
CC(C)(C)[Si](C)(C)OC[C@H]1OC(n2ccc(=O)[nH]c2=O)=C(c2ccccc2)[C@@H]1O[Si](C)(C)C(C)(C)C,CO,253.0
CC(C)(C)[Si](C)(C)OCc1cc(C=C(C#N)C(=O)O)sc1C=C1C=C(c2ccccc2)OC(c2ccccc2)=C1,ClCCl,570.0
CC(C)(C)[Si](C)(C)c1ccc([Si](C)(C)C(C)(C)C)c2ccccc12,C1CCCCC1,302.0
CC(C)(C)[Si](C)(C)c1cccc2ccccc12,C1CCCCC1,295.0
CC(C)(C)c1c2ccc3[nH]c4c(ccc5c(C(C)(C)C)c(ccc6[nH]c7c(ccc1c7n2)c6C(C)(C)C)nc54)c3C(C)(C)C,Cc1ccccc1,764.0
CC(C)(C)c1cc(-c2c3cc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc([nH]4)c(-c4ccc(Br)cc4)c4nc(c(-c5ccc(Br)cc5)c5ccc2[nH]5)C=C4)N=C3)cc(C(C)(C)C)c1,ClCCl,726.0
CC(C)(C)c1cc(-c2c3cc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc([nH]4)c(-c4ccc([N+](=O)[O-])cc4)c4nc(c(-c5ccc([N+](=O)[O-])cc5)c5ccc2[nH]5)C=C4)N=C3)cc(C(C)(C)C)c1,ClCCl,726.0
CC(C)(C)c1cc(-c2c3cccc4c5cccc6c(-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7cccc8c9cccc2c9c(c34)c(c65)c78)cc(C(C)(C)C)c1,Cc1ccccc1,687.0
CC(C)(C)c1cc(-c2c3nc(cc4[nH]c(cc4/C=C/C(=O)O)c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4nc(cc5[nH]c2cc5C=CC(=O)O)C(C=CC(=O)O)=C4)C(/C=C/C(=O)O)=C3)cc(C(C)(C)C)c1,CCO,450.0
CC(C)(C)c1cc(-c2cc3c(cc(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)n3-c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)n2-c2ccc(C(=C(c3ccccc3)c3ccccc3)c3ccccc3)cc2)cc(C(C)(C)C)c1,ClCCl,337.0
CC(C)(C)c1cc(-c2ccc(-c3cc(C(C)(C)C)cc(C(C)(C)C)c3)cc2)cc(C(C)(C)C)c1,C1COCCO1,281.0
CC(C)(C)c1cc(-c2ccc(-c3cccs3)s2)c2c(c1)c1cc(C(C)(C)C)cc(-c3ccc(-c4cccs4)s3)c1n2-c1ccc(-c2cccs2)s1,ClCCl,340.0
CC(C)(C)c1cc(-c2ccc3c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)cc4c5cc(-c6cc(C(C)(C)C)cc(C(C)(C)C)c6)ccc5c(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4c3c2)cc(C(C)(C)C)c1,ClCCl,351.0
CC(C)(C)c1cc(/C2=C3/N=C(/C(c4cc(C(C)(C)C)cc(C(C)(C)C)c4)=c4/cc/c5n4[Zn]n4c2ccc4/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2\N=C(/C=5c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4cc(/C=C/C(=O)O)c(/C=C/C(=O)O)cc42)c2cc(C#Cc4ccccc4)c(C#Cc4ccccc4)cc23)cc(C(C)(C)C)c1,C1CCOC1,475.0
CC(C)(C)c1cc(/C2=C3\C=C(C=CC(=O)O)C(=N3)/C=c3/c(C=CC(=O)O)c/c4n3[Zn]n3c2cc(/C=C/C(=O)O)c3/C=C2\N=C(C=C2/C=C/C(=O)O)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,CCO,466.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#CC#N)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,458.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#C[N+](=O)[O-])=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,452.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3c4cc5ccccc5cc4c(C#Cc4ccc(C(=O)O)cc4)c4cc5ccccc5cc34)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,429.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3c4ccccc4c(C#Cc4ccc(C(=O)O)cc4)c4cc5ccccc5cc34)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,430.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3c4ccccc4c(C#Cc4ccc(C(=O)O)cc4)c4ccccc34)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,421.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc(-c4ccccc4)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,660.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc(C#Cc4ccc(C(=O)O)cc4)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,449.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc4c(c3)Cc3ccccc3-4)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,663.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc4c5c(cccc35)CC4)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,664.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(C#Cc3cncnc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,656.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,C1CCOC1,627.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,CCO,627.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c2c2nc5ccc6cc(C(=O)O)ccc6c5nc2c3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,ClCCl,614.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)cc(C(C)(C)C)c1,ClCCl,590.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)cc(C(C)(C)C)c1,ClCCl,609.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc4c5ccc6c7ccc8c9c(ccc(c%10ccc(c%11c4n3[Ni]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC%11=N2)c5c%106)c97)C(=O)OC8=O)cc(C(C)(C)C)c1,ClC(Cl)Cl,805.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3ccc(Br)cc3)=c3/cc/c([nH]3)=C(\c3ccc(Br)cc3)C3=N/C(=C(/c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4cc2c[nH]4)C=C3)cc(C(C)(C)C)c1,CC(=O)N(C)C,702.0
CC(C)(C)c1cc(/C2=C3\C=CC(=N3)/C(c3ccc([N+](=O)[O-])cc3)=c3/cc/c([nH]3)=C(\c3ccc([N+](=O)[O-])cc3)C3=N/C(=C(/c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4cc2c[nH]4)C=C3)cc(C(C)(C)C)c1,CC(=O)N(C)C,701.0
CC(C)(C)c1cc(/C=C/C=C/C=C2/N(CCCS(=O)(=O)[O-])c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCC(=O)O)[o+]c2cc(N(Cc3cccc(S(=O)(=O)[O-])c3)Cc3cccc(S(=O)(=O)[O-])c3)ccc12,CCO,779.0
CC(C)(C)c1cc(/C=C/C=C/C=C2\N(CCCS(=O)(=O)[O-])c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCC(=O)O)c2cc3c(cc2[o+]1)N(CCCS(=O)(=O)[O-])C(C)(C)C=C3CS(=O)(=O)[O-],CCO,748.0
CC(C)(C)c1cc(/C=C/C=C/C=C2\N(CCC[SH](=O)([O-])O)c3ccc([SH](=O)([O-])O)cc3C2(C)CCCC(=O)O)c2ccc(N(CCCS(=O)(=O)[O-])CCCS(=O)(=O)[O-])cc2[o+]1,CCO,733.0
CC(C)(C)c1cc(/C=C/C=C2/N(CCC[SH](=O)([O-])O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCC(=O)O)[o+]c2cc(N(Cc3cccc(S(=O)(=O)[O-])c3)Cc3cccc(S(=O)(=O)[O-])c3)ccc12,CCO,685.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)C)c2cc3c4c(c2[o+]1)CCCN4CCC3,CCO,648.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)C)c2ccc(N)cc2[o+]1,CCO,623.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)c2cc3c4c(c2[o+]1)CCCN4CCC3,CCO,648.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)c2ccc(N)cc2[o+]1,CCO,623.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCCS(=O)(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCC(=O)O)c2cc3c(cc2[o+]1)N(CCCS(=O)(=O)[O-])C(C)(C)C=C3CS(=O)(=O)O,CCO,653.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCCS(=O)(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCC(=O)O)c2cc3c4c(c2[o+]1)CCCN4CCC3,CCO,647.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCCS(=O)(=O)[O-])c3ccc(S(=O)(=O)O)cc3C2(C)CCCC(=O)O)c2cc3c4c(c2[o+]1)CCCN4CCC3,CCO,647.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCC[SH](=O)(O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCC(=O)O)c2ccc(N(CCCS(=O)(=O)O)CCCS(=O)(=O)O)cc2[o+]1,CCO,636.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCC[SH](=O)(O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCC(=O)O)c2ccc(N(CCCS(=O)(=O)[O-])CCCS(=O)(=O)O)cc2[o+]1,CCO,636.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCC[SH](=O)(O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCC(=O)O)c2ccc(N(CCCS(=O)(=O)[O-])CCCS(=O)(=O)[O-])cc2[o+]1,CCO,636.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCC[SH](=O)([O-])O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCC(=O)O)c2ccc(N(CCCS(=O)(=O)[O-])CCCS(=O)(=O)[O-])cc2[o+]1,CCO,636.0
CC(C)(C)c1cc(/C=C/C=C2\N(CCC[SH](=O)([O-])O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCC(=O)O)c2ccc(N(CCCS(=O)(=O)[O-])CCCS(=O)(=O)[O-])cc2[o+]1,CCO,636.0
CC(C)(C)c1cc(/C=C/CC/C=C2\N(CCC[SH](=O)([O-])O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCC(=O)O)c2cc3c4c(c2[o+]1)CCCN4CCC3,CCO,743.0
CC(C)(C)c1cc(C#Cc2ccc3c(C#Cc4cc(C(C)(C)C)cc(C(C)(C)C)c4)cc4c5cc(C#Cc6cc(C(C)(C)C)cc(C(C)(C)C)c6)ccc5c(C#Cc5cc(C(C)(C)C)cc(C(C)(C)C)c5)cc4c3c2)cc(C(C)(C)C)c1,ClCCl,416.0
CC(C)(C)c1cc(C(C)(C)C)c(-c2nnc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)o2)c(C(C)(C)C)c1,Cc1ccccc1,340.0
CC(C)(C)c1cc(C(C)(C)C)c2oc3c(c2c1)C=CN1C(=O)C2=C4c5oc6c(C(C)(C)C)cc(C(C)(C)C)cc6c5C=CN4C(=O)C2=C31,CN(C)C=O,645.0
CC(C)(C)c1cc(C(C)(C)C)c2oc3c(c2c1)C=CN1C(=O)C2=C4c5oc6c(C(C)(C)C)cc(C(C)(C)C)cc6c5C=CN4C(=O)C2=C31,ClC(Cl)Cl,643.0
CC(C)(C)c1cc(C=NN=Cc2ccc3ccc4cccc5ccc2c3c45)c(O)c(C(C)(C)C)c1,CC#N,391.0
CC(C)(C)c1cc(CN2C(=O)/C(=c3\s/c(=C/c4ccc(-c5ccc(-c6ccc(-c7ccc8c(c7)C7CCCC7N8c7ccc(C=C(c8ccccc8)c8ccccc8)cc7)s6)s5)s4)c(=O)n3CC(=O)O)SC2=S)cc(C(C)(C)C)c1,ClC(Cl)Cl,550.0
CC(C)(C)c1cc(CN2C(=O)/C(=c3\s/c(=C/c4ccc(-c5ccc(-c6ccc7c(c6)C6CCCC6N7c6ccc(C=C(c7ccccc7)c7ccccc7)cc6)s5)s4)c(=O)n3CC(=O)O)SC2=S)cc(C(C)(C)C)c1,ClC(Cl)Cl,564.0
CC(C)(C)c1cc(CN2C(=O)/C(=c3\s/c(=C/c4ccc(-c5ccc6c(c5)C5CCCC5N6c5ccc(C=C(c6ccccc6)c6ccccc6)cc5)s4)c(=O)n3CC(=O)O)SC2=S)cc(C(C)(C)C)c1,ClC(Cl)Cl,568.0
CC(C)(C)c1cc(C[n+]2ccc(-c3cc[n+](Cc4cc(C(C)(C)C)cc(C(C)(C)C)c4)cc3)cc2)cc(C(C)(C)C)c1,CC#N,259.0
CC(C)(C)c1cc2c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc(C(F)(F)F)cc3)c3cccc4c(-c5ccc(C(F)(F)F)cc5)c(-c5ccc(C(F)(F)F)cc5)c(c1)[n+]2c34,ClCCl,351.0
CC(C)(C)c1cc2c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)c3cccc4c(-c5ccc(Cl)cc5)c(-c5ccc(Cl)cc5)c(c1)[n+]2c34,ClCCl,354.0
CC(C)(C)c1cc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)c(c1)[n+]2c34,ClCCl,438.0
CC(C)(C)c1cc2c(-c3cccc(C#N)c3)c(-c3cccc(C#N)c3)c3cccc4c(-c5cccc(C#N)c5)c(-c5cccc(C#N)c5)c(c1)[n+]2c34,ClCCl,351.0
CC(C)(C)c1cc2c(-c3cccc4ccccc34)c(-c3cccc4ccccc34)c3cccc4c(-c5cccc6ccccc56)c(-c5cccc6ccccc56)c(c1)[n+]2c34,ClCCl,352.0
CC(C)(C)c1cc2c(-c3ccccc3)c(-c3ccccc3)c3cccc4c(-c5ccccc5)c(-c5ccccc5)c(c1)[n+]2c34,ClCCl,354.0
CC(C)(C)c1cc2c(c(C(C)(C)C)c1)O[B-](F)(F)[n+]1c-2nc(-c2ccccc2)c2cc(Cl)ccc21,Cc1ccccc1,420.0
CC(C)(C)c1cc2c(c(C(C)(C)C)c1)O[B-](F)(F)[n+]1c-2nc(-c2ccccc2)c2ccccc21,Cc1ccccc1,410.0
CC(C)(C)c1cc2c(c(C(C)(C)C)c1)O[B-]1(c3ccc([B-]45OC(c6ccccc6)=N[N+]4=Cc4cc(C(C)(C)C)cc(C(C)(C)C)c4O5)cc3)OC(c3ccccc3)=N[N+]1=C2,C1CCOC1,455.0
CC(C)(C)c1cc2c3c(c1)-c1cccc4c1N(B3N1c3ccccc3Sc3cccc-2c31)c1ccccc1S4,C1CCOC1,381.0
CC(C)(C)c1cc2c3c(c1)-c1cccc4c1N(B3N1c3ccccc3Sc3cccc-2c31)c1ccccc1S4,ClCCl,381.0
CC(C)(C)c1cc2c3c(c1)C(C)(C)c1cc(C(C)(C)C)cc4c1N3c1c(cc(-c3cc5sc(C=C(C#N)C(=O)O)cc5s3)cc1C4(C)C)C2(C)C,C1CCOC1,456.0
CC(C)(C)c1cc2c3c(c1)C(C)(C)c1cc(C(C)(C)C)cc4c1N3c1c(cc(-c3sc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)c5c3OCCO5)cc1C4(C)C)C2(C)C,C1CCOC1,491.0
CC(C)(C)c1cc2c3c(c1)C(C)(C)c1cc(C(C)(C)C)cc4c1N3c1c(cc(C=Cc3sc(C=C(C#N)C(=O)O)c5c3OCCO5)cc1C4(C)C)C2(C)C,ClC(Cl)Cl,558.0
CC(C)(C)c1cc2c3cc(C(C)(C)C)c(-c4cc5cc6c7cccc8cccc(c9cc(C(C)(C)C)cc(c5cc4C(C)(C)C)c96)c87)cc3cc3c4cccc5cccc(c(c1)c23)c54,CC1CCCCC1,446.0
CC(C)(C)c1cc2cc(N(c3ccccc3)c3ccccc3)c3cc(C(C)(C)C)cc4cc(N(c5ccccc5)c5ccccc5)c(c1)c2c43,CCCCCC,398.0
CC(C)(C)c1cc2ccc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc4c5nc6cc(C#N)c(C#N)cc6nc5c(c1)c2c34,Cc1ccccc1,500.0
CC(C)(C)c1cc2ccc3c(N(c4ccc(F)cc4)c4ccc(F)cc4)cc(N(c4ccc(F)cc4)c4ccc(F)cc4)c4ccc(c1)c2c34,ClCCl,414.0
CC(C)(C)c1cc2ccc3c(N(c4ccccc4)c4ccccc4)cc(N(c4ccccc4)c4ccccc4)c4ccc(c1)c2c34,ClCCl,414.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c(N(c5ccccc5)c5ccccc5)cc(c1)c2c34,CCCCCC,392.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,C1CCOC1,395.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,CC#N,394.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,CC(C)=O,395.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,CCCCCC,399.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,CCO,395.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,CCOC(C)=O,393.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,CO,382.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,CS(C)=O,394.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,Cc1ccc(C)cc1,396.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,ClC(Cl)(Cl)Cl,401.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,ClC(Cl)Cl,401.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc(c5c43)c21,c1ccccc1,395.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,C1CCOC1,354.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,CC#N,365.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,CC(C)=O,365.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,CCCCCC,367.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,CCO,366.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,CCOC(C)=O,366.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,CO,362.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,CS(C)=O,368.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,Cc1ccc(C)cc1,368.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,ClC(Cl)(Cl)Cl,369.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,ClC(Cl)Cl,368.0
CC(C)(C)c1cc2ccc3cc(C(C)(C)C)cc4c3c2c(c1)c(=O)n1c4nc2c3ccccc3c3ccccc3c21,c1ccccc1,369.0
CC(C)(C)c1cc2ccc3ccc(-c4cc(-c5ccc6ccc7cc(C(C)(C)C)cc8ccc5c6c78)c5ccc6c(-c7ccc8ccc9cc(C(C)(C)C)cc%10ccc7c8c9%10)cc(-c7ccc8ccc9cc(C(C)(C)C)cc%10ccc7c8c9%10)c7ccc4c5c76)c4ccc(c1)c2c34,CN(C)C=O,397.0
CC(C)(C)c1cc2ccc3ccc(-c4ccc(C(c5ccc(-c6ccc7ccc8cc(C(C)(C)C)cc9ccc6c7c89)cc5)C(c5ccc(-c6ccc7ccc8cc(C(C)(C)C)cc9ccc6c7c89)cc5)c5ccc(-c6ccc7ccc8cc(C(C)(C)C)cc9ccc6c7c89)cc5)cc4)c4ccc(c1)c2c34,C1CCOC1,342.0
CC(C)(C)c1cc2ccc3ccc(-c4ccc5ccc6cccc7ccc4c5c67)c4ccc(c1)c2c34,CN(C)C=O,350.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,C1CCOC1,395.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,CC#N,389.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,CC(C)=O,391.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,CCCCCC,393.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,CCO,390.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,CCOC(C)=O,390.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,CO,382.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,CS(C)=O,391.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,Cc1ccc(C)cc1,392.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,ClC(Cl)(Cl)Cl,395.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,ClC(Cl)Cl,395.0
CC(C)(C)c1cc2ccc3cccc4c3c2c(c1)c1nc2c3cc(C(C)(C)C)cc5ccc6cccc(c(=O)n2c41)c6c53,c1ccccc1,395.0
CC(C)(C)c1ccc(-[n+]2nc3c(-c4ccc(Oc5ccccc5)cc4)cc(C(C)(C)C)cc3c3ccc(Oc4ccccc4)cc32)cc1,ClCCl,526.0
CC(C)(C)c1ccc(-[n+]2nc3c(-c4ccccc4)cc(C(C)(C)C)cc3c3ccccc32)cc1,ClCCl,483.0
CC(C)(C)c1ccc(-[n+]2nc3ccccc3c3ccccc32)cc1,ClCCl,382.0
CC(C)(C)c1ccc(-c2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(C#N)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,340.0
CC(C)(C)c1ccc(-c2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,341.0
CC(C)(C)c1ccc(-c2c(-c3ccc(C(C)(C)C)cc3)c3cc(C(C)(C)C)cc4c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)c5cccc2c5[n+]34)cc1,ClCCl,358.0
CC(C)(C)c1ccc(-c2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,316.0
CC(C)(C)c1ccc(-c2c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c(C#N)c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,360.0
CC(C)(C)c1ccc(-c2c(-c3cccc(N(c4ccccc4)c4ccccc4)c3)c(C#N)c(-c3cccc(N(c4ccccc4)c4ccccc4)c3)c(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,297.0
CC(C)(C)c1ccc(-c2c3c(c(-c4ccccc4)c4cc5ccccc5cc24)Cc2c(c(-c4ccccc4)c4cc5ccccc5cc4c2-c2ccc(C(C)(C)C)cc2)C3)cc1,ClCCl,392.0
CC(C)(C)c1ccc(-c2c3ccc(=[NH2+])cc-3sc3cc(N)ccc23)cc1,O,520.0
CC(C)(C)c1ccc(-c2c3cccc4c(-c5ccccc5)cc5c(-c6ccc(C(C)(C)C)cc6)c6cccc7c(-c8ccccc8)cc2c(c76)c5c43)cc1,ClCCl,454.0
CC(C)(C)c1ccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]2=C3)cc1,CC#N,557.0
CC(C)(C)c1ccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]2=C3)cc1,CCCCCC,568.0
CC(C)(C)c1ccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]2=C3)cc1,CN(C)C=O,566.0
CC(C)(C)c1ccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]2=C3)cc1,Cc1ccccc1,573.0
CC(C)(C)c1ccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]2=C3)cc1,ClCCl,567.0
CC(C)(C)c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc(C(C)(C)C)cc5)c(C#N)s4)s3)sc2C#N)cc1,ClCCl,392.0
CC(C)(C)c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc(C(C)(C)C)cc5)c(C(=O)N5CCCC5)s4)s3)sc2C(=O)N2CCCC2)cc1,ClCCl,378.0
CC(C)(C)c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc(C(C)(C)C)cc5)c(C(=O)N5CCCCC5)s4)s3)sc2C(=O)N2CCCCC2)cc1,ClCCl,378.0
CC(C)(C)c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc(C(C)(C)C)cc5)c(C(=O)N5CCOCC5)s4)s3)sc2C(=O)N2CCOCC2)cc1,ClCCl,377.0
CC(C)(C)c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc(C(C)(C)C)cc5)c(C(=O)NC5CCCCC5)s4)s3)sc2C(=O)NC2CCCCC2)cc1,ClCCl,394.0
CC(C)(C)c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc(C(C)(C)C)cc5)c(C(=O)NCc5ccccc5)s4)s3)sc2C(=O)NCc2ccccc2)cc1,ClCCl,394.0
CC(C)(C)c1ccc(-c2cc(-c3ccc(-c4cc(-c5ccc(C(C)(C)C)cc5)c(C(=O)NCc5cccs5)s4)s3)sc2C(=O)NCc2cccs2)cc1,ClCCl,394.0
CC(C)(C)c1ccc(-c2cc3c(-c4ccc(C(C)(C)C)cc4)c4cccc5c(-c6ccc(C(C)(C)C)cc6)cc6c(-c7ccc(C(C)(C)C)cc7)c7cccc2c7c3c6c54)cc1,ClCCl,456.0
CC(C)(C)c1ccc(-c2cc3c(-c4ccc(F)cc4)c(-c4ccc(F)cc4)oc4c5oc(-c6ccc(F)cc6)c(-c6ccc(F)cc6)c6cc(-c7ccc(C(C)(C)C)cc7)cc(c(c2)c34)c65)cc1,ClCCl,422.0
CC(C)(C)c1ccc(-c2cc3c(-c4ccccc4)c(-c4ccccc4)oc4c5oc(-c6ccccc6)c(-c6ccccc6)c6cc(-c7ccc(C(C)(C)C)cc7)cc(c(c2)c34)c65)cc1,ClCCl,425.0
CC(C)(C)c1ccc(-c2cc3c4c(c2)CCc2cc(-c5ccc(C(C)(C)C)cc5)cc(c2-4)CC3)cc1,ClC(Cl)Cl,329.7061683
CC(C)(C)c1ccc(-c2cc3cc4c(cc(-c5ccc(C(C)(C)C)cc5)p4-c4ccccc4)cc3p2-c2ccccc2)cc1,C1CCOC1,396.0
CC(C)(C)c1ccc(-c2cc3ccc(/C=C(/C#N)C(=O)O)c4cc(-c5ccc(C(C)(C)C)cc5)c5ccc2n5c34)cc1,CN(C)C=O,465.0
CC(C)(C)c1ccc(-c2ccc(-c3c4c(nc5ccccc35)-c3cc5c(cc3CC4)-c3nc4ccccc4c(-c4ccc(-c6ccc(C(C)(C)C)cc6)cc4)c3CC5)cc2)cc1,ClC(Cl)Cl,376.0
CC(C)(C)c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1,ClCCl,436.0
CC(C)(C)c1ccc(-c2ccc(C3=C4C(=O)NC(c5ccc(-c6ccc(C(C)(C)C)cc6)cc5)=C4C(=O)N3)cc2)cc1,ClCCl,536.0
CC(C)(C)c1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)cc1,ClCCl,470.0
CC(C)(C)c1ccc(-c2ccc(N(c3ccc(/C=C/c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)cc3)c3ccc(-c4ccc(C(C)(C)C)cc4)cc3)cc2)cc1,CCO,441.0
CC(C)(C)c1ccc(-c2ccc(N(c3ccc(/C=C/c4ccc(/C=C(/C#N)C(=O)O)o4)cc3)c3ccc(-c4ccc(C(C)(C)C)cc4)cc3)cc2)cc1,CCO,456.0
CC(C)(C)c1ccc(-c2ccc(N(c3ccc(/C=C/c4ccc(/C=C(/C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(C(C)(C)C)cc4)cc3)cc2)cc1,CCO,450.0
CC(C)(C)c1ccc(-c2ccc3c(-c4ccc(C(C)(C)C)c5ccccc45)cc4c5cc(-c6ccc(C(C)(C)C)c7ccccc67)ccc5c(-c5ccc(C(C)(C)C)c6ccccc56)cc4c3c2)c2ccccc12,ClCCl,300.0
CC(C)(C)c1ccc(-c2cnc3cccc(-c4ccccc4)n23)cc1,ClCCl,339.0
CC(C)(C)c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)cc3)nc(-c3ccc(C(C)(C)C)cc3)n2)cc1,C1CCOC1,354.4573643
CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3cc(C#N)c(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)c(C#N)c3)n2)cc1,C1CCOC1,397.4806202
CC(C)(C)c1ccc(-c2nc(-c3ccc(C(C)(C)C)cc3)nc(-c3ccc(-n4c5ccccc5c5c6oc7ccccc7c6ccc54)c(C#N)c3)n2)cc1,C1CCOC1,379.4573643
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,368.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1COCCO1,369.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CC#N,367.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCCC,366.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCOCCCC,367.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCN(CC)CC,367.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOC(C)=O,367.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOCC,366.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CN(C)C=O,369.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,369.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClC=C(Cl)Cl,370.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5c6ccccc6cc6ccccc56)cc4c4cc(-c5c6ccccc6cc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClCCl,370.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1COCCO1,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CC#N,324.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCCC,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCOCCCC,326.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCN(CC)CC,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOC(C)=O,324.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOCC,234.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CN(C)C=O,328.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,327.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClC=C(Cl)Cl,327.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cc6ccccc6c6ccccc56)cc4c4cc(-c5cc6ccccc6c6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClCCl,328.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,346.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1COCCO1,346.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CC#N,347.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCCC,345.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCOCCCC,345.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCN(CC)CC,345.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOC(C)=O,345.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOCC,346.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CN(C)C=O,348.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,350.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClC=C(Cl)Cl,349.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccc6ccc7cccc8ccc5c6c78)cc4c4cc(-c5ccc6ccc7cccc8ccc5c6c78)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClCCl,348.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1COCCO1,326.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CC#N,323.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCCC,326.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCOCCCC,327.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCN(CC)CC,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOC(C)=O,324.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOCC,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CN(C)C=O,327.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,328.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClC=C(Cl)Cl,327.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5cccc6ccccc56)cc4c4cc(-c5cccc6ccccc56)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClCCl,325.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,331.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1COCCO1,333.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CC#N,329.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCCC,331.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCOCCCC,331.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCN(CC)CC,332.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOC(C)=O,329.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOCC,330.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CN(C)C=O,331.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,333.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClC=C(Cl)Cl,332.0
CC(C)(C)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClCCl,330.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1,ClCCl,332.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,314.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,C1COCCO1,315.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CC#N,310.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCCC,315.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCCCOCCCC,315.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCN(CC)CC,316.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOC(C)=O,313.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CCOCC,313.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,CN(C)C=O,313.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,316.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClC=C(Cl)Cl,316.0
CC(C)(C)c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)cc1,ClCCl,313.0
CC(C)(C)c1ccc(-c2nc3ccc(-c4ccc5nc(-c6ccc(C(C)(C)C)cc6)oc5c4)cc3o2)cc1,CCCCCCC,332.0
CC(C)(C)c1ccc(-c2nc3ccccc3nc2-c2cc(-c3nc4ccccc4nc3-c3ccc(C(C)(C)C)cc3)cc(-n3c4ccccc4c4ccccc43)c2)cc1,Cc1ccccc1,344.0
CC(C)(C)c1ccc(-c2nc3ccccc3o2)cc1,CCCCCCC,302.0
CC(C)(C)c1ccc(-c2ncc3cccc(-c4ccccc4)n23)cc1,ClCCl,339.0
CC(C)(C)c1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,C1CCOC1,392.0
CC(C)(C)c1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,CC#N,390.0
CC(C)(C)c1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,CC1CCCCC1,391.0
CC(C)(C)c1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,CCCCCC,391.0
CC(C)(C)c1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,Cc1ccccc1,394.0
CC(C)(C)c1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,ClC(Cl)Cl,394.0
CC(C)(C)c1ccc(-c2nnc3ccccn23)cc1,ClCCl,282.0
CC(C)(C)c1ccc(-c2oc3c4oc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)c5cc(Br)cc(c6cc(Br)cc(c2-c2ccc(C(C)(C)C)cc2)c63)c54)cc1,ClCCl,422.0
CC(C)(C)c1ccc(-c2oc3c4oc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)c5cccc(c6cccc(c2-c2ccc(C(C)(C)C)cc2)c63)c54)cc1,ClCCl,432.0
CC(C)(C)c1ccc(-c2sc(-c3ccc(C(C)(C)C)cc3)c3[nH]c(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)cc4)nc23)cc1,C1CCOC1,426.0
CC(C)(C)c1ccc(-c2sc(-c3ccc(C(C)(C)C)cc3)c3[nH]c(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)nc23)cc1,C1CCOC1,428.0
CC(C)(C)c1ccc(-c2sc(-c3ccc(C(C)(C)C)cc3)c3[nH]c(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)cc4)nc23)cc1,C1CCOC1,362.0
CC(C)(C)c1ccc(-c2sc(-c3ccc(C(C)(C)C)cc3)c3[nH]c(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4)nc23)cc1,C1CCOC1,392.0
CC(C)(C)c1ccc(-c2sc(-c3ccc(C(C)(C)C)cc3)c3[nH]c(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)nc23)cc1,C1CCOC1,428.0
CC(C)(C)c1ccc(-c2sc3c(-c4ccc(C(C)(C)C)cc4)c4n(c3c2-c2ccc(C(C)(C)C)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(C(C)(C)C)cc5)c5sc(-c6ccc(C(C)(C)C)cc6)c(-c6ccc(C(C)(C)C)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CC#N,574.0
CC(C)(C)c1ccc(-c2sc3c(-c4ccc(C(C)(C)C)cc4)c4n(c3c2-c2ccc(C(C)(C)C)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(C(C)(C)C)cc5)c5sc(-c6ccc(C(C)(C)C)cc6)c(-c6ccc(C(C)(C)C)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CCCCCC,591.0
CC(C)(C)c1ccc(-c2sc3c(-c4ccc(C(C)(C)C)cc4)c4n(c3c2-c2ccc(C(C)(C)C)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(C(C)(C)C)cc5)c5sc(-c6ccc(C(C)(C)C)cc6)c(-c6ccc(C(C)(C)C)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CN(C)C=O,584.0
CC(C)(C)c1ccc(-c2sc3c(-c4ccc(C(C)(C)C)cc4)c4n(c3c2-c2ccc(C(C)(C)C)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(C(C)(C)C)cc5)c5sc(-c6ccc(C(C)(C)C)cc6)c(-c6ccc(C(C)(C)C)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,Cc1ccccc1,596.0
CC(C)(C)c1ccc(-c2sc3c(-c4ccc(C(C)(C)C)cc4)c4n(c3c2-c2ccc(C(C)(C)C)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(C(C)(C)C)cc5)c5sc(-c6ccc(C(C)(C)C)cc6)c(-c6ccc(C(C)(C)C)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,ClCCl,591.0
CC(C)(C)c1ccc(-n2c(-c3ccc(-c4cc(-c5ccccc5)c(-c5ccccc5)c(-c5ccccc5)c4-c4ccccc4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,C1CCOC1,365.0
CC(C)(C)c1ccc(-n2c(-c3ccc(-c4cc(-c5ccccc5)c5c(c4-c4ccccc4)-c4cccc6cccc-5c46)cc3)nc3c4ccccc4c4ccccc4c32)cc1,C1CCOC1,367.0
CC(C)(C)c1ccc(-n2c(-c3ccc(-c4cc(-c5ccccc5)c5c6ccccc6c6ccccc6c5c4-c4ccccc4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,C1CCOC1,365.0
CC(C)(C)c1ccc(-n2c(-c3ccc(-c4ccc(-c5c(-c6ccccc6)nc6ccccn56)cc4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,ClCCl,364.0
CC(C)(C)c1ccc(-n2c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)nc3c4ccccc4c4ccccc4c32)cc1,ClCCl,356.0
CC(C)(C)c1ccc(-n2c(-c3ccc(-c4cccc(-c5c(-c6ccccc6)nc6ccccn56)c4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,ClCCl,365.0
CC(C)(C)c1ccc(-n2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3c3cc(C(C)(C)C)ccc32)cc1,C1CCOC1,465.0
CC(C)(C)c1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)s4)ccc32)cc1,C1CCOC1,428.0
CC(C)(C)c1ccc(/C2=C3/N=C(C=C3/C=C(/C#N)C(=O)O)/C(c3ccc(C(C)(C)C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(C)(C)C)cc2)=C2\N=C(C(c3ccccc3)=C2c2ccccc2)/C=4c2ccc(C(C)(C)C)cc2)cc1,ClCCl,628.0
CC(C)(C)c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(C)(C)C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(C)(C)C)cc2)=C2\N=C(C=C2/C=C(\C#N)C(=O)O)/C=4c2ccc(C(C)(C)C)cc2)cc1,ClCCl,623.0
CC(C)(C)c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(C)(C)C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(C)(C)C)cc2)=C2\N=C(C=C2C#Cc2ccc(C(=O)O)cc2)/C=4c2ccc(C(C)(C)C)cc2)cc1,ClCCl,606.0
CC(C)(C)c1ccc(/C=C/c2ccc(N(c3ccc(/C=C/c4ccc(C(C)(C)C)cc4)cc3)c3ccc(-c4nc5ccccc5nc4-c4ccc(N(c5ccc(/C=C/c6ccc(C(C)(C)C)cc6)cc5)c5ccc(/C=C/c6ccc(C(C)(C)C)cc6)cc5)cc4)cc3)cc2)cc1,C1CCOC1,375.0
CC(C)(C)c1ccc(/C=C/c2ccc(N(c3ccc(/C=C/c4ccc(C(C)(C)C)cc4)cc3)c3ccc(-c4nc5ccccc5nc4-c4ccc(N(c5ccc(/C=C/c6ccc(C(C)(C)C)cc6)cc5)c5ccc(/C=C/c6ccc(C(C)(C)C)cc6)cc5)cc4)cc3)cc2)cc1,Cc1ccccc1,373.0
CC(C)(C)c1ccc(/C=c2\o/c(=C\c3ccccc3)c3ccccc23)cc1,ClCCl,375.0
CC(C)(C)c1ccc(C#Cc2c(C#Cc3ccc(C(C)(C)C)cc3)c(C#Cc3ccc(C(C)(C)C)cc3)c(C#Cc3ccc(C(C)(C)C)cc3)c(C#Cc3ccc(C(C)(C)C)cc3)c2C#Cc2ccc(C(C)(C)C)cc2)cc1,ClCCl,379.0
CC(C)(C)c1ccc(C#Cc2c(C#Cc3ccc(C(C)(C)C)cc3)c3cccc4c(C#Cc5ccc(C(C)(C)C)cc5)c(C#Cc5ccc(C(C)(C)C)cc5)c5cccc2c5c34)cc1,ClCCl,410.0
CC(C)(C)c1ccc(C#Cc2cc(C#Cc3ccc(C(C)(C)C)cc3)c(C#Cc3ccc(C(C)(C)C)cc3)c(C#Cc3ccc(C(C)(C)C)cc3)c2C#Cc2ccc(C(C)(C)C)cc2)cc1,ClCCl,373.0
CC(C)(C)c1ccc(C#Cc2cc3c(C#Cc4ccc(C(C)(C)C)cc4)c(C#Cc4ccc(C(C)(C)C)cc4)c4cc(C#Cc5ccc(C(C)(C)C)cc5)cc5c(C#Cc6ccc(C(C)(C)C)cc6)c(C#Cc6ccc(C(C)(C)C)cc6)c(c2)c3c45)cc1,ClCCl,414.0
CC(C)(C)c1ccc(C#Cc2cc3ccc4cc(C#Cc5ccc(C(C)(C)C)cc5)cc5ccc(c2)c3c45)cc1,ClCCl,410.0
CC(C)(C)c1ccc(C#Cc2nc(C#Cc3ccc(C(C)(C)C)cc3)c(C#Cc3ccc(C(C)(C)C)cc3)c(C#Cc3ccc(C(C)(C)C)cc3)c2C#Cc2ccc(C(C)(C)C)cc2)cc1,ClCCl,421.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)ccc(c34)C2=O)c1,CO,447.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)ccc(c34)C2=O)c1,CS(C)=O,445.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)ccc(c34)C2=O)c1,Cc1ccccc1,440.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccc([N+](=O)[O-])cc6)s5)ccc(c34)C2=O)c1,CO,393.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccc([N+](=O)[O-])cc6)s5)ccc(c34)C2=O)c1,CS(C)=O,400.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccc([N+](=O)[O-])cc6)s5)ccc(c34)C2=O)c1,Cc1ccccc1,392.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccccc6)s5)ccc(c34)C2=O)c1,CO,403.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccccc6)s5)ccc(c34)C2=O)c1,CS(C)=O,405.0
CC(C)(C)c1ccc(C(C)(C)C)c(N2C(=O)c3cccc4c(-c5ccc(-c6ccccc6)s5)ccc(c34)C2=O)c1,Cc1ccccc1,398.0
CC(C)(C)c1ccc(C2=C(Br)C3=C(c4ccccc4)c4c(Br)c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,C1CCCCC1,577.0
CC(C)(C)c1ccc(C2=C(Br)C3=C(c4ccccc4)c4c(Br)c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,577.0
CC(C)(C)c1ccc(C2=C(Br)C3=C(c4ccccc4)c4c(Br)c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,CC#N,559.0
CC(C)(C)c1ccc(C2=C(Br)C3=C(c4ccccc4)c4c(Br)c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,581.0
CC(C)(C)c1ccc(C2=C(Br)C3=C(c4ccccc4)c4c(Br)c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,ClCCl,572.0
CC(C)(C)c1ccc(C2=C(c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)S(=O)(=O)c3c2sc(-c2ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc2)c3-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,429.0
CC(C)(C)c1ccc(C2=C(c3ccc(-n4c5ccccc5c5ccccc54)cc3)S(=O)(=O)c3c2sc(-c2ccc(-n4c5ccccc5c5ccccc54)cc2)c3-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,419.0
CC(C)(C)c1ccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)cc1,C1CCCCC1,589.0
CC(C)(C)c1ccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)cc1,C1CCOC1,585.0
CC(C)(C)c1ccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)cc1,CC#N,563.0
CC(C)(C)c1ccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)cc1,Cc1ccccc1,591.0
CC(C)(C)c1ccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)cc1,ClCCl,579.0
CC(C)(C)c1ccc(C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)S(=O)(=O)c3c2sc(-c2ccc(N(c4ccccc4)c4ccccc4)cc2)c3-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,463.0
CC(C)(C)c1ccc(C2=C(c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)S(=O)(=O)c3c2sc(-c2ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc2)c3-c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,403.0
CC(C)(C)c1ccc(C2=CC(=Cc3ccc(/C=C(\C#N)C(=O)O)s3)C=C(c3ccc(C(C)(C)C)cc3)O2)cc1,ClCCl,573.0
CC(C)(C)c1ccc(C2=CC(=Cc3sc(/C=C(\C#N)C(=O)O)c4c3OCCO4)C=C(c3ccc(C(C)(C)C)cc3)O2)cc1,ClCCl,594.0
CC(C)(C)c1ccc(C2=CC(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)cc(-c4ccccc4)n2[B-]3(F)F)cc1,C1CCOC1,654.0
CC(C)(C)c1ccc(C2=CC(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)cc(-c4ccccc4)n2[B-]3(F)F)cc1,Cc1ccccc1,657.0
CC(C)(C)c1ccc(C2=CC(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)cc(-c4ccccc4)n2[B-]3(F)F)cc1,ClC(Cl)Cl,654.0
CC(C)(C)c1ccc(C2=CC3=C(c4ccccc4)c4cc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,C1CCCCC1,602.0
CC(C)(C)c1ccc(C2=CC3=C(c4ccccc4)c4cc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,C1CCOC1,601.0
CC(C)(C)c1ccc(C2=CC3=C(c4ccccc4)c4cc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,CC#N,590.0
CC(C)(C)c1ccc(C2=CC3=C(c4ccccc4)c4cc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,605.0
CC(C)(C)c1ccc(C2=CC3=C(c4ccccc4)c4cc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)cc1,ClCCl,598.0
CC(C)(C)c1ccc(C2=Cc3cc4c(cc3P2(=O)c2ccccc2)C=C(c2ccc(C(C)(C)C)cc2)P4(=O)c2ccccc2)cc1,C1CCOC1,433.0
CC(C)(C)c1ccc(C2=[N+]3C(=C(c4ccc(N(c5ccc(C6=C7C=CC(c8ccc(C(C)(C)C)cc8)=[N+]7[B-](F)(F)n7c6ccc7-c6ccc(C(C)(C)C)cc6)cc5)c5ccc(-c6ccc(C(=O)O)cc6)cc5)cc4)c4ccc(-c5ccc(C(C)(C)C)cc5)n4[B-]3(F)F)C=C2)cc1,ClCCl,561.0
CC(C)(C)c1ccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)cc1,C1CCCCC1,687.0
CC(C)(C)c1ccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)cc1,C1CCOC1,683.0
CC(C)(C)c1ccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)cc1,CC#N,677.0
CC(C)(C)c1ccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)cc1,Cc1ccccc1,687.0
CC(C)(C)c1ccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4ccc(C(C)(C)C)cc4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)cc1,ClCCl,683.0
CC(C)(C)c1ccc(C2=c3sc(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)c3=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)c4sc(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(C(C)(C)C)cc5)c4n2[B-]3(F)F)cc1,ClC(Cl)Cl,767.0
CC(C)(C)c1ccc(C2=c3sc(-c4ccc(C(C)(C)C)cc4)cc3=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)c4sc(-c5ccc(C(C)(C)C)cc5)cc4n2[B-]3(F)F)cc1,ClC(Cl)Cl,767.0
CC(C)(C)c1ccc(C2=c3sc4ccccc4c3=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)c4sc5ccccc5c4n2[B-]3(F)F)cc1,C1CCOC1,709.0
CC(C)(C)c1ccc(C2=c3sc4ccccc4c3=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)c4sc5ccccc5c4n2[B-]3(F)F)cc1,Cc1ccccc1,715.0
CC(C)(C)c1ccc(C2=c3sc4ccccc4c3=[N+]3C2=Nc2c(-c4ccc(C(C)(C)C)cc4)c4sc5ccccc5c4n2[B-]3(F)F)cc1,ClC(Cl)Cl,711.0
CC(C)(C)c1ccc(Cn2nc(-c3ccc(Cl)cc3)cc2-c2nnc(-c3cccc(Br)c3)o2)cc1,ClCCl,274.0
CC(C)(C)c1ccc(Cn2nc(-c3ccc(Cl)cc3)cc2-c2nnc(-c3ccccc3)o2)cc1,ClCCl,274.0
CC(C)(C)c1ccc(Cn2nc(-c3ccc(Cl)cc3)cc2-c2nnc(COc3ccc(Cl)cc3)o2)cc1,ClCCl,263.0
CC(C)(C)c1ccc(Cn2nc(-c3ccc(Cl)cc3)cc2-c2nnc(COc3ccc([N+](=O)[O-])cc3)o2)cc1,ClCCl,263.0
CC(C)(C)c1ccc(Cn2nc(-c3ccccc3)cc2-c2nnc(-c3ccccc3)o2)cc1,ClCCl,271.0
CC(C)(C)c1ccc(N(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc(/C=C/C=C/C(=O)O)/c4n3[Zn]n3c(ccc32)/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=C(/C=C/C=C/C(=O)O)C(=N2)/C=4)c2ccc(C(C)(C)C)cc2)cc1,CCO,441.0
CC(C)(C)c1ccc(N(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=C(/C=C/C(=O)O)C(=N2)/C=4)c2ccc(C(C)(C)C)cc2)cc1,CCO,421.0
CC(C)(C)c1ccc(N(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=C(/C=C/C=C/C(=O)O)C(=N2)/C=4)c2ccc(C(C)(C)C)cc2)cc1,CCO,422.0
CC(C)(C)c1ccc(N(/C2=c3\cc/c4n3[Zn]n3c(cc(/C=C/C=C/C(=O)O)c3/C=C3\N=C(C=C3/C=C/C=C/C(=O)O)/C=4c3cc(C(C)(C)C)cc(C(C)(C)C)c3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=C3/C=CC2=N3)c2ccc(C(C)(C)C)cc2)cc1,CCO,650.0
CC(C)(C)c1ccc(N(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=C3/C=CC2=N3)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c2ccc(C(C)(C)C)cc2)cc1,CCO,644.0
CC(C)(C)c1ccc(N(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=C3/C=CC2=N3)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c2ccc(C(C)(C)C)cc2)cc1,ClCCl,644.0
CC(C)(C)c1ccc(N(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=C3/C=CC2=N3)/C=C2\N=C(C=C2/C=C/C(=O)O)/C=4c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c2ccc(C(C)(C)C)cc2)cc1,CCO,618.0
CC(C)(C)c1ccc(N(c2ccc(-c3ccc(C4=[O+][B-](F)(F)OC(c5ccc(-c6ccc(C(=O)O)cc6)cc5)=C4)cc3)cc2)c2ccc(C(C)(C)C)cc2)cc1,CC#N,487.0
CC(C)(C)c1ccc(N(c2ccc(-c3ccc(C4=[O+][B-](F)(F)OC(c5ccc(C(=O)O)cc5)=C4)cc3)cc2)c2ccc(C(C)(C)C)cc2)cc1,CC#N,494.0
CC(C)(C)c1ccc(N(c2ccc(-c3nnc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)s3)cc2)c2ccc(C(C)(C)C)cc2)cc1,ClC(Cl)Cl,453.0
CC(C)(C)c1ccc(N(c2ccc(-c3nnc(-c4ccc(-c5ccc(C=C(C(=O)O)c6ccccc6)s5)s4)s3)cc2)c2ccc(C(C)(C)C)cc2)cc1,ClC(Cl)Cl,443.0
CC(C)(C)c1ccc(N(c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)c2ccc(C(C)(C)C)cc2)cc1,CC#N,407.0
CC(C)(C)c1ccc(N(c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)c2ccc(C(C)(C)C)cc2)cc1,CCCCCC,407.0
CC(C)(C)c1ccc(N(c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)c2ccc(C(C)(C)C)cc2)cc1,CO,407.0
CC(C)(C)c1ccc(N(c2ccc(/C=C(\C#N)C(=O)O)cc2)c2ccc(C(C)(C)C)cc2)cc1,CC#N,426.0
CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)c2cc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)c3ccc4cc(C(C)(C)C)cc5ccc2c3c54)cc1,ClCCl,425.0
CC(C)(C)c1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc3c(c2)/C=N/c2ccc(C(=O)O)cc2/N=C/c2cc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)ccc2O[Zn]O3)cc1,C1CCOC1,470.0
CC(C)(C)c1ccc(N(c2ccc(C3=[O+][B-](F)(F)OC(c4ccc(-c5ccc(C(=O)O)cc5)cc4)=C3)cc2)c2ccc(C(C)(C)C)cc2)cc1,CC#N,483.0
CC(C)(C)c1ccc(N(c2ccc(C3=[O+][B-](F)(F)OC(c4ccc(C(=O)O)cc4)=C3)cc2)c2ccc(C(C)(C)C)cc2)cc1,CC#N,484.0
CC(C)(C)c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)s3)cc2)cc1,C1CCOC1,433.0
CC(C)(C)c1ccc(N2CCCc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)s4)ccc32)cc1,C1CCOC1,454.0
CC(C)(C)c1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3C(C)(C)c3cc(C(C)(C)C)ccc32)cc1,C1CCOC1,489.0
CC(C)(C)c1ccc(N2c3ccc(C(C)(C)C)cc3B3c4cc(C(C)(C)C)ccc4N(c4ccc(C(C)(C)C)cc4)c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc2c43)cc1,Cc1ccccc1,451.0
CC(C)(C)c1ccc(Oc2c3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6c(Oc7ccc(C(C)(C)C)cc7)c(Oc7ccc(C(C)(C)C)cc7)c7c8c(cc(Oc9ccc(C(C)(C)C)cc9)c(c(c2Oc2ccc(C(C)(C)C)cc2)c45)c86)C(=O)OC7=O)C(=O)OC3=O)cc1,ClC(Cl)Cl,571.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6c(Oc7ccc(C(C)(C)C)cc7)cc7c8c(cc(Oc9ccc(C(C)(C)C)cc9)c(c2c45)c86)C(=O)C2=C7O[B-](F)(F)[n+]4c2ccc2ccccc24)C2=C(C3=O)c3ccc4ccccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,650.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7cc(C(=O)O)nc(C(=O)O)c7)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,CN(C)C=O,536.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7cc(C(=O)O)nc(C(=O)O)c7)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,ClCCl,534.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7ccc(C(=O)O)cc7)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,CN(C)C=O,536.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7ccc(C(=O)O)cc7)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,ClCCl,535.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7ccc(O)c8ncccc78)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,CN(C)C=O,545.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7ccc(O)c8ncccc78)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,ClCCl,546.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7ccc(P(=O)(O)O)cc7)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,CN(C)C=O,536.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(C#Cc7ccc(P(=O)(O)O)cc7)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,ClCCl,535.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5ccc(C(C)(C)C)cc5)c5c6ccc(Oc7ccc(C(=O)O)cc7)c7cccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,ClCCl,517.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5cccc(C(C)(C)C)c5)c5c6cccc7c(C#Cc8cc(C(=O)O)nc(C(=O)O)c8)ccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,CN(C)C=O,536.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5cccc(C(C)(C)C)c5)c5c6cccc7c(C#Cc8ccc(O)c9ncccc89)ccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,CN(C)C=O,545.0
CC(C)(C)c1ccc(Oc2cc3c4c(cc(Oc5cccc(C(C)(C)C)c5)c5c6cccc7c(C#Cc8ccc(P(=O)(O)O)cc8)ccc(c2c45)c76)C(=O)N(c2cc(C(C)(C)C)ccc2C(C)(C)C)C3=O)cc1,CN(C)C=O,536.0
CC(C)(C)c1ccc(Oc2cc3c4c(ccc5c6c(Oc7ccc(C(C)(C)C)cc7)cc7c8c(ccc(c2c45)c86)C(=O)N(c2ccc4c(c2)C2(c5ccccc5-4)c4cc(N(c5ccccc5)c5ccccc5)ccc4-c4ccc(N(c5ccccc5)c5ccccc5)cc42)C7=O)C(=O)OC3=O)cc1,ClCCl,546.0
CC(C)(C)c1ccc(Oc2cc3c4c(ccc5c6c(Oc7ccc(C(C)(C)C)cc7)cc7c8c(ccc(c2c45)c86)C(=O)OC7=O)C(=O)OC3=O)cc1,ClCCl,544.0
CC(C)(C)c1ccc(Oc2ccc3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)C)cc7)c(c7cccc2c73)c46)c(=O)n2c3ccc(C(=O)O)cc3nc52)cc1,ClCCl,560.0
CC(C)(C)c1ccc2[nH]c3c(-c4ccc(N(c5ccc(C=c6sc(=C(C#N)C#N)[nH]c6=O)cc5)c5ccc(-c6cc(C(C)(C)C)cc7c6[nH]c6ccc(C(C)(C)C)cc67)cc5)cc4)cc(C(C)(C)C)cc3c2c1,ClCCl,521.0
CC(C)(C)c1ccc2c(-c3ccc([Si](C)(C)c4ccc5ccc6cccc7ccc4c5c67)cc3)c3ccccc3c(-c3ccc([Si](C)(C)c4ccc5ccc6cccc7ccc4c5c67)cc3)c2c1,ClCCl,299.0
CC(C)(C)c1ccc2c(-c3ccccc3[Si](C)(C)C=Cc3ccc(-c4cccc5[nH]c6ccccc6c45)cc3)c3ccccc3c(-c3ccccc3[Si](C)(C)C=Cc3ccc(-c4cccc5[nH]c6ccccc6c45)cc3)c2c1,ClCCl,294.0
CC(C)(C)c1ccc2c(-c3ccccc3[Si](C)(C)c3ccc(-c4cccc5[nH]c6ccccc6c45)cc3)c3ccccc3c(-c3ccccc3[Si](C)(C)c3ccc(-c4cccc5[nH]c6ccccc6c45)cc3)c2c1,ClCCl,295.0
CC(C)(C)c1ccc2c(N(c3ccccc3)c3cccc4ccccc34)c3cc(C(C)(C)C)ccc3c(-c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)s3)c2c1,C1CCOC1,772.0
CC(C)(C)c1ccc2c(N(c3ccccc3)c3cccc4ccccc34)c3cc(C(C)(C)C)ccc3c(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)c2c1,C1CCOC1,436.0
CC(C)(C)c1ccc2c(N(c3ccccc3)c3cccc4ccccc34)c3cc(C(C)(C)C)ccc3c(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)c2c1,C1CCOC1,628.0
CC(C)(C)c1ccc2c(N(c3ccccc3)c3cccc4ccccc34)c3cc(C(C)(C)C)ccc3c(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2c1,C1CCOC1,434.0
CC(C)(C)c1ccc2c(N(c3ccccc3)c3cccc4ccccc34)c3cc(C(C)(C)C)ccc3c(-c3ccc(C=C(C#N)C(=O)O)s3)c2c1,C1CCOC1,634.0
CC(C)(C)c1ccc2c(c1)-c1c3c(c4c5c1-c1cc(C(C)(C)C)ccc1OB5Oc1ccc(C(C)(C)C)cc1-4)-c1cc(C(C)(C)C)ccc1OB3O2,ClCCl,411.0
CC(C)(C)c1ccc2c(c1)C1=N/C2=N\c2c3cc(C(C)(C)C)ccc3c3n2[Zn]n2/c(c4ccc(C(C)(C)C)cc4/c2=N/C2=N/C(=N\3)c3cc(O)c(O)cc32)=N\1,CCO,680.0
CC(C)(C)c1ccc2c(c1)C1=NC2=Nc2c3ccc(C(C)(C)C)cc3c3n2[Zn]n2c(c4ccc(C(C)(C)C)cc4c2=N1)=NC1=NC(=N3)c2cc3cc(C(=O)O)ccc3cc21,CCO,694.0
CC(C)(C)c1ccc2c(c1)Cc1cc(C(C)(C)C)ccc1-2,C1CCCCC1,308.0
CC(C)(C)c1ccc2c(c1)Sc1cc(C(C)(C)C)ccc1N2c1ccc(/C=C(\C#N)C(=O)O)cc1,CC#N,403.0
CC(C)(C)c1ccc2c(c1)Sc1cc(C(C)(C)C)ccc1N2c1ccc2c(ccc3nc4ccc5cc(N6c7ccc(C(C)(C)C)cc7Sc7cc(C(C)(C)C)ccc76)ccc5c4nc32)c1,C1CCCCC1,451.0
CC(C)(C)c1ccc2c(c1)Sc1cc(C(C)(C)C)ccc1N2c1ccc2c(ccc3nc4ccc5cc(N6c7ccc(C(C)(C)C)cc7Sc7cc(C(C)(C)C)ccc76)ccc5c4nc32)c1,C1CCOC1,452.0
CC(C)(C)c1ccc2c(c1)Sc1cc(C(C)(C)C)ccc1N2c1ccc2c(ccc3nc4ccc5cc(N6c7ccc(C(C)(C)C)cc7Sc7cc(C(C)(C)C)ccc76)ccc5c4nc32)c1,Cc1ccccc1,451.0
CC(C)(C)c1ccc2c(c1)[nH]c1c3[nH]c4cc(C(C)(C)C)ccc4c3c3nsnc3c21,CN(C)C=O,412.0
CC(C)(C)c1ccc2c(c1)[nH]c1c3[nH]c4cc(C(C)(C)C)ccc4c3c3nsnc3c21,Cc1ccccc1,406.0
CC(C)(C)c1ccc2c(c1)[nH]c1c3[nH]c4cc(C(C)(C)C)ccc4c3c3nsnc3c21,ClCCl,411.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)cc3c1n2-c1cc(-c2ccc(F)cc2)cc2c1B3c1cc(C(C)(C)C)cc3c4cc(C(C)(C)C)ccc4n-2c13,Cc1ccccc1,469.9177438
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)cc3c1n2-c1cc(-c2cccc(F)c2)cc2c1B3c1cc(C(C)(C)C)cc3c4cc(C(C)(C)C)ccc4n-2c13,Cc1ccccc1,467.0975323
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)cc3c1n2-c1cc(-c2ccccc2F)cc2c1B3c1cc(C(C)(C)C)cc3c4cc(C(C)(C)C)ccc4n-2c13,Cc1ccccc1,471.5628672
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)cc3c1n2B1c2c-3cccc2-c2cc(C(C)(C)C)cc3c4cc(C(C)(C)C)ccc4n1c23,C1CCOC1,387.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)cc3c1n2B1c2c-3cccc2-c2cc(C(C)(C)C)cc3c4cc(C(C)(C)C)ccc4n1c23,ClCCl,369.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)cc3c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4n2c13,C1CCOC1,461.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1c(C#N)c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21,Cc1ccccc1,427.95
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc(C(=O)c2ccccc2)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1,Cc1ccccc1,391.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc(C(=O)c2ccccn2)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1,Cc1ccccc1,394.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc(C(=O)c2cccnc2)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1,Cc1ccccc1,381.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc(C(=O)c2ccncc2)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1,Cc1ccccc1,396.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc(N2c3ccccc3C(c3ccccc3)(c3ccccc3)c3ccccc32)cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1C#N,Cc1ccccc1,378.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cc[n+]2c(c1)-c1ccccc1O[B-]2(F)F,Cc1ccccc1,375.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2ccc(-c3cc4c(s3)-c3sc(/C=C(\C#N)C(=O)O)cc3C4(C)C)s2)s1,C1CCOC1,501.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)cc1,ClC(Cl)Cl,438.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)s1,ClCCl,435.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2ccc3c(c2)C(=O)c2ccc(-c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4)cc2C3=O)cc1,Cc1ccccc1,426.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2ccc3c(c2)C2(c4cc(-c5ccc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)cc5)ccc4-3)c3ccccc3S(=O)(=O)c3ccccc32)cc1,ClCCl,353.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,C1CCOC1,386.9330454
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,CC#N,380.0215983
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,CC(C)=O,380.0215983
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,CN(C)C=O,384.4492441
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,Cc1ccccc1,393.1965443
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClC(Cl)Cl,430.0699301
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClCCl,382.7213823
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,C1CCOC1,364.7291942
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,CC#N,361.4266843
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,CC(C)=O,366.1822985
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,CN(C)C=O,365.9180978
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,Cc1ccccc1,375.9577279
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClC(Cl)Cl,435.7808858
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClCCl,375.2972259
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c2c1c1ccccc1n2-c1ccccc1,Cc1ccccc1,375.0681199
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc3c(C#N)ccc(C#N)c3nc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,Cc1ccccc1,467.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(-c2nc3cc(C#N)c(C#N)cc3nc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,Cc1ccccc1,443.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)=C2/C=CC(=N2)/C=4c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,590.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)s3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)=C2/C=CC(=N2)/C=4c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)s2)s1,ClCCl,597.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(/C=C(\C#N)C(=O)O)cc1,CC#N,406.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(/C=C/c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,CC#N,429.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccc(C=C(C#N)C(=O)O)cc4)s3)s2)cc1,ClCCl,420.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)cc2)cc1,CC#N,353.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)cc2)cc1,CCCCC,356.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)cc2)cc1,CO,354.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)cc2)cc1,Cc1ccccc1,359.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)cc2)cc1,ClC(Cl)Cl,356.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)cc2)cc1,ClCCl,355.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C#Cc3ccc(C=C(C#N)C#N)cc3)cc2)cc1,ClCCl,382.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C=C(C#N)C#N)cc2)cc1,CC#N,346.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C=C(C#N)C#N)cc2)cc1,CCCCC,345.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C=C(C#N)C#N)cc2)cc1,Cc1ccccc1,348.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C=C(C#N)C#N)cc2)cc1,ClCCl,410.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc(C=O)cc2)cc1,ClCCl,354.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc3c4ccc(C#Cc5ccc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)cc5)cc4n(-c4ccc(C(F)(F)F)cc4)c3c2)cc1,ClCCl,353.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc3c4ccc(C#Cc5ccc(/C=C(/C#N)C(=O)O)cc5)cc4n(-c4ccc(C(F)(F)F)cc4)c3c2)cc1,ClCCl,386.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc3c4ccc(C#Cc5ccc(C=C(C#N)C#N)cc5)cc4n(-c4ccc(C(F)(F)F)cc4)c3c2)cc1,ClCCl,355.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc3c4ccc(C#Cc5ccc(C=C(C#N)C(=O)O)cc5)cc4n(-c4ccc(C(F)(F)F)cc4)c3c2)cc1,ClCCl,385.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2ccc3c4ccc(C#Cc5ccc(C=O)cc5)cc4n(-c4ccc(C(F)(F)F)cc4)c3c2)cc1,ClCCl,377.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2cccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c2)cc1,CC#N,340.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2cccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c2)cc1,CCCCC,340.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2cccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c2)cc1,CO,338.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2cccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c2)cc1,Cc1ccccc1,345.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2cccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c2)cc1,ClC(Cl)Cl,344.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#Cc2cccc(C#Cc3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c2)cc1,ClCCl,345.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=CC#N)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,Cc1ccccc1,364.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=O)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)nc2)cn1,C1CCOC1,377.3087071
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=O)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)nc2)cn1,Cc1ccccc1,383.9662447
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=O)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)nc2)cn1,ClCCl,382.7176781
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=O)c2ccncc2)cc1,C1CCOC1,367.3249551
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=O)c2ccncc2)cc1,CCCCCC,372.1723519
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=O)c2ccncc2)cc1,Cc1ccccc1,373.6641221
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C(=O)c2ccncc2)cc1,ClCCl,377.9174147
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C2(c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c3ccccc3-c3ccccc32)cc1,ClCCl,430.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C=C(C#N)C(=O)O)cc1,C1CCOC1,347.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C=C(C#N)C(=O)O)cc1,CC#N,381.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C=Cc2ccc(C=C(C#N)C(=O)O)s2)cc1,CC#N,429.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(N(c7ccc(-n8c9ccc(C(C)(C)C)cc9c9cc(C(C)(C)C)ccc98)cc7)c7ccc(-n8c9ccc(C(C)(C)C)cc9c9cc(C(C)(C)C)ccc98)cc7)cc6)cc5)c5nsnc45)cc3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,422.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(N(c7ccc(-n8c9ccc(C(C)(C)C)cc9c9cc(C(C)(C)C)ccc98)cc7)c7ccc(-n8c9ccc(C(C)(C)C)cc9c9cc(C(C)(C)C)ccc98)cc7)cc6)s5)c5nsnc45)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,528.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,487.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,487.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(-c4ccc(-c5ccc(N(c6ccc(-n7c8ccc(C(C)(C)C)cc8c8cc(C(C)(C)C)ccc87)cc6)c6ccc(-n7c8ccc(C(C)(C)C)cc8c8cc(C(C)(C)C)ccc87)cc6)cc5)s4)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,418.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,455.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(-c4ccc(N(c5ccc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)cc5)c5ccc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)cc5)cc4)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,396.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,458.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)s3)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClC(Cl)Cl,507.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(N(c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(N(c6ccc(-n7c8ccc(C(C)(C)C)cc8c8cc(C(C)(C)C)ccc87)cc6)c6ccc(-n7c8ccc(C(C)(C)C)cc8c8cc(C(C)(C)C)ccc87)cc6)cc5)ccc3-4)cc2)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc2)cc1,ClCCl,373.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(S(=O)(=O)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cn2)nc1,Cc1ccccc1,365.7686212
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(S(=O)(=O)c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)nc2)cn1,Cc1ccccc1,355.6259905
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(S(=O)(=O)c2ccc(S(=O)(=O)c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)cc2)cc1,Cc1ccccc1,363.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(S(=O)(=O)c2cccc(S(=O)(=O)c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc3)c2)cc1,Cc1ccccc1,348.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2c(c1)C(=O)c1ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc1C2=O,Cc1ccccc1,463.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc1n2-c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)s1,ClCCl,415.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc1n2-c1ccc(/C=C(\C#N)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)s2)cc1,ClCCl,465.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)ccc43)ccc1n2-c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)s1,ClCCl,413.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2c3ccc(C#Cc4ccc(C=C(C#N)C(=O)O)cc4)cc3n(-c3ccc(C(F)(F)F)cc3)c2c1,ClCCl,395.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2cc(/C=C(\C#N)c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc2c1,ClCCl,470.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2oc3nc4oc5cc(C(F)(F)F)ccc5c4cc3c2c1,ClC(Cl)Cl,346.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2oc3nc4oc5ccc(C(F)(F)F)cc5c4cc3c2c1,C1CCCCC1,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2oc3nc4oc5ccc(C(F)(F)F)cc5c4cc3c2c1,C1CCOC1,338.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2oc3nc4oc5ccc(C(F)(F)F)cc5c4cc3c2c1,CC#N,336.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2oc3nc4oc5ccc(C(F)(F)F)cc5c4cc3c2c1,CS(C)=O,337.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2oc3nc4oc5ccc(C(F)(F)F)cc5c4cc3c2c1,Cc1ccccc1,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc2oc3nc4oc5ccc(C(F)(F)F)cc5c4cc3c2c1,ClC(Cl)Cl,345.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,C1CCOC1,344.3632568
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,CC#N,344.3632568
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,CC(C)=O,344.3632568
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,CN(C)C=O,344.3632568
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,Cc1ccccc1,344.3632568
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,ClC(Cl)Cl,344.3632568
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,ClCCl,344.3632568
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,C1CCOC1,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,CC#N,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,CC(C)=O,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,CN(C)C=O,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,Cc1ccccc1,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,ClC(Cl)Cl,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-c2nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)n2)c1,ClCCl,343.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)c1C#N,Cc1ccccc1,367.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(C(=O)c2cccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)n2)n1,C1CCOC1,336.5789474
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(C(=O)c2cccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)n2)n1,Cc1ccccc1,337.9227053
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc(C(=O)c2cccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)n2)n1,ClCCl,336.5789474
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccc2c1Oc1c(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cccc1C2(C)C,Cc1ccccc1,346.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,C1CCOC1,343.1654676
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,CC#N,340.6988695
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,CC(C)=O,343.1654676
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,CN(C)C=O,343.1654676
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,Cc1ccccc1,340.6988695
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,ClC(Cl)Cl,343.1654676
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,ClCCl,343.1654676
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,C1CCOC1,343.5612083
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,CC#N,347.5357711
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,CC(C)=O,343.8791733
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,CN(C)C=O,345.9459459
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,Cc1ccccc1,320.3497615
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,ClC(Cl)Cl,342.9252782
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccccc1-c1nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)nc(-c2ccccc2P(=O)(c2ccccc2)c2ccccc2)n1,ClCCl,341.4944356
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1cccs1,ClCCl,340.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1nc2ccccc2nc1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21,Cc1ccccc1,419.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2CCCCCCN1c2ccccc2Sc2cc(/C=C/C(=O)O)ccc21,C1CCOC1,376.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2CCCCCN1c2ccccc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,C1CCOC1,435.0
CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2CCCCCN1c2ccccc2Sc2cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)ccc21,C1CCOC1,460.0
CC(C)(C)c1ccc2c(c1)c1cc3c4cc(C(C)(C)C)ccc4c4c5c6ccc(C(C)(C)C)cc6c6cc7c8cc(C(C)(C)C)ccc8c8c2c1c(c34)c(c78)c65,CCCCCC,542.1523448
CC(C)(C)c1ccc2c(c1)c1cc3c4cc(C(C)(C)C)ccc4c4c5c6ccc(C(C)(C)C)cc6c6cc7c8cc(C(C)(C)C)ccc8c8c2c1c(c34)c(c78)c65,CCOCC,541.5651232
CC(C)(C)c1ccc2c(c1)c1cc3c4cc(C(C)(C)C)ccc4c4c5c6ccc(C(C)(C)C)cc6c6cc7c8cc(C(C)(C)C)ccc8c8c2c1c(c34)c(c78)c65,Cc1ccccc1,545.8515284
CC(C)(C)c1ccc2c(c1)c1ccc3cccc4c5cccc6oc(=O)c2c(c65)c1c34,C1CCOC1,412.0
CC(C)(C)c1ccc2c(c1)c1cccc3cnc2n31,CO,424.0
CC(C)(C)c1ccc2c(c1)c1ccccc1n1c3ccccc3nc21,CC#N,329.0
CC(C)(C)c1ccc2c(c1)c1ncncc1c1c3ccccc3sc21,ClCCl,377.0
CC(C)(C)c1ccc2c(c1)n[n+](-c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1ccccc21,ClCCl,443.0
CC(C)(C)c1ccc2c(c1)oc1nc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3cc12,ClC(Cl)Cl,350.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=C1C#N,C1CCOC1,539.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=C1C#N,CC#N,532.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=C1C#N,CCCCCC,542.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=C1C#N,Cc1ccccc1,543.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=C1C#N,ClCCl,538.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=N1,C1CCOC1,494.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=N1,CC#N,488.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=N1,CCCCCC,490.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=N1,Cc1ccccc1,498.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4c(Br)ccc2c43)=N1,ClCCl,463.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=C1C#N,C1CCOC1,525.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=C1C#N,CC#N,519.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=C1C#N,CCCCCC,529.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=C1C#N,Cc1ccccc1,529.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=N1,C1CCOC1,482.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=N1,CC#N,476.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=N1,CCCCCC,485.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=N1,Cc1ccccc1,486.0
CC(C)(C)c1ccc2c(c1)sc1[n+]2[B-](F)(F)n2c(c3cccc4cccc2c43)=N1,ClCCl,451.0
CC(C)(C)c1ccc2c3c(c4ccc(C(C)(C)C)cc4c2c1)=[N+]1C(=C(c2ccccc2)c2cc4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]1(F)F)C=3,C1CCCCC1,693.0
CC(C)(C)c1ccc2c3c(c4ccc(C(C)(C)C)cc4c2c1)=[N+]1C(=C(c2ccccc2)c2cc4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]1(F)F)C=3,C1CCOC1,689.0
CC(C)(C)c1ccc2c3c(c4ccc(C(C)(C)C)cc4c2c1)=[N+]1C(=C(c2ccccc2)c2cc4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]1(F)F)C=3,CC#N,683.0
CC(C)(C)c1ccc2c3c(c4ccc(C(C)(C)C)cc4c2c1)=[N+]1C(=C(c2ccccc2)c2cc4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]1(F)F)C=3,Cc1ccccc1,694.0
CC(C)(C)c1ccc2c3c(c4ccc(C(C)(C)C)cc4c2c1)=[N+]1C(=C(c2ccccc2)c2cc4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]1(F)F)C=3,ClCCl,691.0
CC(C)(C)c1ccc2c3ccccc3n(-c3ccc4c(-c5ccccc5)c5cc(-n6c7ccccc7c7cccc(C(C)(C)C)c76)ccc5c(-c5ccccc5)c4c3)c2c1,ClCCl,334.0
CC(C)(C)c1ccc2ccc3cc(-c4ccc5c(-c6ccc7c(ccc8ccc(C(C)(C)C)cc87)c6)cc6c7cc(-c8ccc9c(ccc%10ccc(C(C)(C)C)cc%109)c8)ccc7c(-c7ccc8c(ccc9ccc(C(C)(C)C)cc98)c7)cc6c5c4)ccc3c2c1,ClCCl,303.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,C1CCCCC1,372.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,C1CCOC1,374.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,CC#N,371.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,CC1CCCCC1,373.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,CCCCO,375.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,CCO,373.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,CN(C)C=O,374.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,Cc1ccccc1,376.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,Clc1ccccc1Cl,379.0
CC(C)(C)c1ccc2oc(-c3ccc(-c4nc5cc(C(C)(C)C)ccc5o4)s3)nc2c1,c1ccccc1,377.0
CC(C)(C)c1ccc2oc3nc4oc5ccc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)cc5c4cc3c2c1,ClC(Cl)Cl,346.0
CC(C)(C)c1ccc2oc3nc4oc5ccc(-n6c7ccccc7c(=O)c7ccccc76)cc5c4cc3c2c1,ClC(Cl)Cl,396.0
CC(C)(C)c1ccc2oc3nc4oc5ccc(-n6c7ccccc7c7cc(-n8c9ccccc9c9ccccc98)ccc76)cc5c4cc3c2c1,ClC(Cl)Cl,348.0
CC(C)(C)c1ccc2oc3nc4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c4cc3c2c1,ClC(Cl)Cl,348.0
CC(C)(C)c1ccc2oc3nc4oc5ccc(N(c6ccccc6)c6ccccc6)cc5c4cc3c2c1,ClC(Cl)Cl,342.0
CC(C)(C)c1ccc2oc3nc4oc5ccc(N6c7ccccc7Oc7ccccc76)cc5c4cc3c2c1,ClC(Cl)Cl,347.0
CC(C)(C)c1ccc2oc3nc4oc5ccc(N6c7ccccc7Sc7ccccc76)cc5c4cc3c2c1,ClC(Cl)Cl,348.0
CC(C)(C)c1cccc(-[n+]2nc3cc(C(C)(C)C)ccc3c3cc(Br)ccc32)c1,ClCCl,395.0
CC(C)(C)c1cccc(-[n+]2nc3cc(C(C)(C)C)ccc3c3cc(Cl)ccc32)c1,ClCCl,393.0
CC(C)(C)c1cccc(-[n+]2nc3cc(C(C)(C)C)ccc3c3ccc(-c4ccccc4)cc32)c1,ClCCl,478.0
CC(C)(C)c1cccc(-[n+]2nc3cc(C(C)(C)C)ccc3c3ccc(C(C)(C)C)cc32)c1,ClCCl,445.0
CC(C)(C)c1cccc(-[n+]2nc3cc(C(C)(C)C)ccc3c3ccc(Oc4ccccc4)cc32)c1,ClCCl,484.0
CC(C)(C)c1cccc(-[n+]2nc3cc(C(C)(C)C)ccc3c3ccccc32)c1,ClCCl,434.0
CC(C)(C)c1cccc2c(O)cccc12,O,296.0
CC(C)(C)c1cccc2c1oc1nc3oc4cc(-n5c6ccccc6c6ccccc65)ccc4c3cc12,ClC(Cl)Cl,355.0
CC(C)(C)c1cccc2c1oc1nc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3cc12,ClC(Cl)Cl,348.0
CC(C)(C)c1cccc2c3ccccc3n(-c3ccc4c(-c5ccccc5)c5ccccc5c(-c5ccccc5)c4c3)c12,ClCCl,340.0
CC(C)(C)c1ccn2c3c(c(C(=O)c4ccccc4C(=O)O)c2c1)C(=O)c1ccccc1C3=O,CN(C)C=O,507.0
CC(C)(C)n1c(=O)c2cc3ccc4cccc5ccc(c2c1=O)c3c45,ClC(Cl)Cl,423.0
CC(C)(C=Cc1c2ccccc2cc2ccccc12)C=Cc1c2ccccc2cc2ccccc12,ClC(Cl)Cl,377.0
CC(C)(c1ccc(OCc2c3ccccc3cc3ccccc23)cc1)c1ccc(OCc2c3ccccc3cc3ccccc23)cc1,ClC(Cl)Cl,355.0
CC(C)/C(C=C1Sc2ccccc2N1C)=c1/s/c(=C2\SC(=S)N(CC(=O)O)C2=O)n(CC(=O)O)c1=O,CCO,580.0
CC(C)=CC(=O)c1cc2c(cc1F)NC(C)(C)CC2=O,CC#N,356.0
CC(C)=N[O-],CCO,265.0
CC(C)=O,CCCCCC,279.0
CC(C)=[N+]1N=C2C=CC(I)=CN2[B-]1(F)F,CO,400.0
CC(C)C(=O)NC1=CC(=O)C(=O)c2ccccc21,CCO,270.0
CC(C)C(=O)[O-],CCO,628.0
CC(C)C1=c2c(c3[nH]cc(C(C)C)c3c3ccccc23)=[N+]2C1=Cc1c(C(C)C)c3c4ccccc4c4c(C(C)C)c[nH]c4c3n1[B-]2(F)F,ClC(Cl)Cl,727.0
CC(C)CCC1(CCC(C)C)c2ccccc2-c2ccc(-c3cc(-c4ccc5c(c4)C(CCC(C)C)(CCC(C)C)c4ccccc4-5)c4ccc5c(-c6ccc7c(c6)C(CCC(C)C)(CCC(C)C)c6ccccc6-7)cc(-c6ccc7c(c6)C(CCC(C)C)(CCC(C)C)c6ccccc6-7)c6ccc3c4c65)cc21,ClCCl,395.0
CC(C)CCCC(C)CCN1C(=O)c2ccc3c(-c4ccccc4)c4c5ccc6c7c(ccc(c(-c8ccccc8)c4c4ccc(c2c34)C1=O)c75)C(=O)N(CCC(C)CCCC(C)C)C6=O,ClCCl,630.0
CC(C)CCCC(C)CCOc1cc(C#Cc2c3ccccc3c(C#Cc3ccc(C#Cc4ccc(C#Cc5cccc(C(=O)O)c5)cc4C#N)cc3)c3ccccc23)c(OCCC(C)CCCC(C)C)cc1C#Cc1ccc(C#Cc2ccc(C(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,506.0
CC(C)CCCC(C)CCOc1cc(C#Cc2c3ccccc3c(C#Cc3ccc(C#Cc4cccc(C(=O)O)c4)cc3)c3ccccc23)c(OCCC(C)CCCC(C)C)cc1C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,502.0
CC(C)CCCC(C)CCOc1cc(C#Cc2c3ccccc3c(C#Cc3ccc(C#Cc4cccc(C(=O)O)c4)cc3C#N)c3ccccc23)c(OCCC(C)CCCC(C)C)cc1C#Cc1cc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c1,Cc1ccccc1,517.0
CC(C)CCCC(C)CCOc1cc(C#Cc2c3ccccc3c(C#Cc3ccc(C#Cc4cccc(C(=O)O)c4)cc3C#N)c3ccccc23)c(OCCC(C)CCCC(C)C)cc1C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,521.0
CC(C)CCCC(C)CCOc1cc(C#Cc2c3ccccc3c(C#Cc3ccc(C#Cc4cccc(C(=O)O)c4)cc3C#N)c3ccccc23)c(OCCC(C)CCCC(C)C)cc1C#Cc1ccccc1,Cc1ccccc1,516.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,C1CCCCC1,362.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,CC#N,370.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,CC(C)O,376.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,CCC(C)=O,368.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,CCO,374.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,CCOC(C)=O,366.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,CS(C)=O,376.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,Cc1ccccc1,368.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,ClCCl,373.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)C(=O)CCC3,Clc1ccccc1,370.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,C1CCCCC1,418.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,CC#N,419.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,CC(C)O,417.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,CCC(C)=O,420.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,CCO,410.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,CCOC(C)=O,417.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,CS(C)=O,428.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,Cc1ccccc1,426.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,ClCCl,426.0
CC(C)CCCCN1CCc2c1ccc1c3c(ccc21)CCCC3=O,Clc1ccccc1,427.0
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OC(=O)Oc5cc(/C=C/C=C/c6ccc(N(C)C)cc6)ccc5[N+](=O)[O-])CC[C@]4(C)[C@H]3CC[C@@]21C,CO,448.0
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OC(=O)Oc5cc(/C=C/c6ccc(N(C)C)cc6)ccc5[N+](=O)[O-])CC[C@]4(C)[C@H]3CC[C@@]21C,CO,400.0
CC(C)CCCn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,ClCCl,468.0
CC(C)CCOc1cc(-c2cc(OCCC(C)C)c(/C=C/c3cc(OCCC(C)C)c(/C=C/c4ccc(N(c5ccc6c(c5)C(C)(C)c5ccccc5-6)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)cc3OCCC(C)C)cc2OCCC(C)C)c(OCCC(C)C)cc1C=C(C#N)C(=O)O,C1CCOC1,472.0
CC(C)CCOc1cc(/C=C/c2cc(OCCC(C)C)c(/C=C/c3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)cc2OCCC(C)C)c(OCCC(C)C)cc1C=C(C#N)C(=O)O,C1CCOC1,466.0
CC(C)CCOc1cc(/C=C/c2ccc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3ccc4c(c3)-c3ccccc3C4(C)C)cc2)c(OCCC(C)C)cc1C=Cc1cc(OCCC(C)C)c(/C=C(\C#N)C(=O)O)cc1OCCC(C)C,C1CCOC1,466.0
CC(C)CCOc1cc(/C=C/c2ccc(N(c3ccc4c(c3)-c3ccccc3C4(C)C)c3ccc4c(c3)-c3ccccc3C4(C)C)cc2)c(OCCC(C)C)cc1C=Cc1cc(OCCC(C)C)c(/C=C/c2cc(OCCC(C)C)c(C=C(C#N)C(=O)O)cc2OCCC(C)C)cc1OCCC(C)C,C1CCOC1,472.0
CC(C)CCOc1cc(/C=C/c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c(OCCC(C)C)cc1C=C(C#N)C(=O)O,C1CCOC1,457.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4cc5nc(C(=O)O)c(C(=O)O)nc5cc4/C=C/c4ccc5c(c4)Sc4ccccc4N5c4ccc(OCCC(C)C)cc4)ccc32)cc1,C1CCOC1,413.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6c5ccc(OCCC(C)C)cc5)c5nc(C(=O)O)c(C(=O)O)nc45)ccc32)cc1,C1CCOC1,481.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4ccc5c(c4)Sc4cc(/C=C/c6ccc7c(c6)Sc6cc(/C=C/c8nc9cc(C(=O)O)c(C(=O)O)cc9nc8/C=C/c8ccc9c(c8)Sc8cc(/C=C/c%10ccc%11c(c%10)Sc%10cc(/C=C/c%12ccc%13c(c%12)Sc%12ccccc%12N%13c%12ccc(OCCC(C)C)cc%12)ccc%10N%11c%10ccc(OCCC(C)C)cc%10)ccc8N9c8ccc(OCCC(C)C)cc8)ccc6N7c6ccc(OCCC(C)C)cc6)ccc4N5c4ccc(OCCC(C)C)cc4)ccc32)cc1,C1CCOC1,439.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4ccc5c(c4)Sc4cc(/C=C/c6nc7cc(C(=O)O)c(C(=O)O)cc7nc6/C=C/c6ccc7c(c6)Sc6cc(/C=C/c8ccc9c(c8)Sc8ccccc8N9c8ccc(OCCC(C)C)cc8)ccc6N7c6ccc(OCCC(C)C)cc6)ccc4N5c4ccc(OCCC(C)C)cc4)ccc32)cc1,C1CCOC1,490.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4nc5cc(-c6ccc(C(=O)O)s6)c(-c6ccc(C(=O)O)s6)cc5nc4/C=C/c4ccc5c(c4)Sc4ccccc4N5c4ccc(OCCC(C)C)cc4)ccc32)cc1,C1CCOC1,484.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4nc5cc(C(=O)O)c(C(=O)O)cc5nc4/C=C/c4ccc5c(c4)Sc4ccccc4N5c4ccc(OCCC(C)C)cc4)ccc32)cc1,C1CCOC1,471.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4nc5ccc(C(=O)O)cc5nc4/C=C/c4ccc5c(c4)Sc4ccccc4N5c4ccc(OCCC(C)C)cc4)ccc32)cc1,C1CCOC1,466.0
CC(C)CCOc1ccc(N2c3ccccc3Sc3cc(/C=C/c4nc5ccc(C(=O)O)cc5nc4/C=C/c4ccc5c(c4)Sc4ccccc4N5c4ccc(OCCC(C)C)cc4)ccc32)cc1,ClC(Cl)Cl,477.0
CC(C)CN1C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)C=C1c1ccccc1,C1COCCO1,456.0
CC(C)CN1C(=O)c2cccc3c(N(C)CCO)ccc(c23)C1=O,CC(C)=O,412.0
CC(C)CN1C(=O)c2cccc3c(NCCN)ccc(c23)C1=O,CC(C)=O,431.0
CC(C)CN1C(=O)c2cccc3c(NCCO)ccc(c23)C1=O,ClCCl,430.0
CC(C)CN1C(=O)c2cccc3c(OCCO)ccc(c23)C1=O,CC(C)=O,363.0
CC(C)CN1C(=O)c2cccc3c(SCc4ccccc4)ccc(c23)C1=O,CC#N,389.0
CC(C)C[Si](C#Cc1c2c(=O)c3ccccc3c2c(C#C[Si](CC(C)C)(CC(C)C)CC(C)C)c2c(=O)c3ccccc3c12)(CC(C)C)CC(C)C,ClC(Cl)Cl,524.0
CC(C)Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(CC(C)C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(CC(C)C)cc2)=C2\N=C(C=C2/C=C(\C#N)C(=O)O)/C=4c2ccc(CC(C)C)cc2)cc1,ClCCl,623.0
CC(C)Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(CC(C)C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(CC(C)C)cc2)=C2\N=C(C=C2C#Cc2ccc(C(=O)O)cc2)/C=4c2ccc(CC(C)C)cc2)cc1,ClCCl,606.0
CC(C)NC(=O)c1ccc(N(C)C)cc1,CC#N,300.0
CC(C)Nc1cc(F)c(C(=O)c2cc(F)c(NC(C)C)cc2F)cc1F,CCO,357.0
CC(C)Nc1cc2c(cc1F)c(=O)c1cc(F)c(NC(C)C)cc1n2C,CCO,377.0
CC(C)Nc1cc2c(cc1F)c(=O)c1cc(F)c(NC(C)C)cc1n2C(C)C,CCO,376.0
CC(C)Nc1cc2oc3cc(NC(C)C)c(F)cc3c(=O)c2cc1F,CCO,370.0
CC(C)Nc1cc2sc3cc(NC(C)C)c(F)cc3c(=O)c2cc1F,CCO,377.0
CC(C)Oc1ccc(C#Cc2cc3ccccc3oc2=O)cc1,CC#N,356.0
CC(C)Oc1ccc(C#Cc2ccc3ccc(=O)oc3c2)cc1,CC#N,310.0
CC(C)[NH-],CO,374.0
CC(C)[Si](C#CC1=CC2=c3cc(C#C[Si](C(C)C)(C(C)C)C(C)C)c4nc(C(F)(F)C(F)(F)C(F)(F)F)nc5c(C#C[Si](C(C)C)(C(C)C)C(C)C)cc(c3c54)C3=CC(C#C[Si](C(C)C)(C(C)C)C(C)C)=C4N=C(C(F)(F)C(F)(F)C(F)(F)F)N=C1C4C32)(C(C)C)C(C)C,C1CCOC1,516.0
CC(C)[Si](C#Cc1c2c(=O)c3ccccc3c2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2c(=O)c3ccccc3c12)(C(C)C)C(C)C,ClC(Cl)Cl,525.0
CC(C)[Si](C#Cc1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)oc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)oc12)(C(C)C)C(C)C,C1CCOC1,483.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(-c2ccc(C=C(C#N)C(=O)O)cc2)c2cc3ccccc3cc12)(C(C)C)C(C)C,C1CCOC1,622.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(-c2ccc(C=C(C#N)C(=O)O)s2)c2cc3ccccc3cc12)(C(C)C)C(C)C,C1CCOC1,625.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc3ccccc3cc12)(C(C)C)C(C)C,ClCCl,643.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(ccc4ccccc43)nc12)(C(C)C)C(C)C,CCCCCC,656.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)C1c2ccccc2C3c2ccccc21)(C(C)C)C(C)C,CCCCCC,542.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)Cc1ccccc1-3)(C(C)C)C(C)C,CCCCCC,578.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c4ccccc4c(=O)c4ccccc4c3nc12)(C(C)C)C(C)C,ClCCl,615.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3cc4c(cc3nc12)C1c2ccccc2C4c2ccccc21)(C(C)C)C(C)C,CCCCCC,675.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3cc4c(cc3nc12)C1c2ccccc2C4c2ccccc21)(C(C)C)C(C)C,ClCCl,683.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3ccccc3nc12)(C(C)C)C(C)C,CCCCCC,693.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3ccccc3nc12)(C(C)C)C(C)C,ClCCl,697.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#C[Si](C)(C)C)c2cc3ccccc3cc12)(C(C)C)C(C)C,ClCCl,642.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#Cc2ccc(C=C(C#N)C(=O)O)cc2)c2cc3ccccc3cc12)(C(C)C)C(C)C,C1CCOC1,665.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#Cc2ccc(C=C(C#N)C(=O)O)s2)c2cc3ccccc3cc12)(C(C)C)C(C)C,C1CCOC1,677.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#Cc2ccc(F)cc2)c2cc3ccccc3cc12)(C(C)C)C(C)C,ClCCl,651.0
CC(C)[Si](C#Cc1c2cc3ccccc3cc2c(C#Cc2ccccc2)c2cc3ccccc3cc12)(C(C)C)C(C)C,ClCCl,652.0
CC(C)[Si](C#Cc1c2ccc(C(C)(C)C)cc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2ccc(C(C)(C)C)cc12)(C(C)C)C(C)C,Cc1ccccc1,440.0
CC(C)[Si](C#Cc1c2ccc(C(C)(C)C)cc2c(C#Cc2c3ccc(C(C)(C)C)cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3ccc(C(C)(C)C)cc23)c2ccc(C(C)(C)C)cc12)(C(C)C)C(C)C,Cc1ccccc1,523.0
CC(C)[Si](C#Cc1c2ccc(C(C)(C)C)cc2c(C#Cc2c3ccc(C(C)(C)C)cc3c(C#Cc3c4ccc(C(C)(C)C)cc4c(C#C[Si](C(C)C)(C(C)C)C(C)C)c4ccc(C(C)(C)C)cc34)c3ccc(C(C)(C)C)cc23)c2ccc(C(C)(C)C)cc12)(C(C)C)C(C)C,Cc1ccccc1,570.0
CC(C)[Si](C#Cc1c2ccccc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2cc3c4c(sc3cc12)-c1cc2c(cc1NB4c1ccccc1)-c1sc3cc4c(C#C[Si](C(C)C)(C(C)C)C(C)C)c5ccccc5c(C#C[Si](C(C)C)(C(C)C)C(C)C)c4cc3c1B(c1ccccc1)N2)(C(C)C)C(C)C,C1CCOC1,532.0
CC(C)[Si](C#Cc1c2ccccc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)C1c2ccccc2C3c2ccccc21)(C(C)C)C(C)C,CCCCCC,445.0
CC(C)[Si](C#Cc1c2ccccc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)Cc1ccccc1-3)(C(C)C)C(C)C,CCCCCC,486.0
CC(C)[Si](C#Cc1c2ccccc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c4ccccc4c(=O)c4ccccc4c3nc12)(C(C)C)C(C)C,ClCCl,509.0
CC(C)[Si](C#Cc1c2ccccc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3cc4c(cc3nc12)C1c2ccccc2C4c2ccccc21)(C(C)C)C(C)C,CCCCCC,558.0
CC(C)[Si](C#Cc1c2ccccc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3cc4c(cc3nc12)C1c2ccccc2C4c2ccccc21)(C(C)C)C(C)C,ClCCl,562.0
CC(C)[Si](C#Cc1c2ccccc2c(C#Cc2c3ccccc3c(C#Cc3c4ccccc4c(C#Cc4c5ccccc5c(C#C[Si](C(C)C)(C(C)C)C(C)C)c5ccccc45)c4ccccc34)c3ccccc23)c2ccccc12)(C(C)C)C(C)C,Cc1ccccc1,582.0
CC(C)[Si](C#Cc1c2ccccc2c(C#Cc2c3ccccc3c(C#Cc3c4ccccc4c(C#Cc4c5ccccc5c(C#Cc5c6ccccc6c(C#C[Si](C(C)C)(C(C)C)C(C)C)c6ccccc56)c5ccccc45)c4ccccc34)c3ccccc23)c2ccccc12)(C(C)C)C(C)C,Cc1ccccc1,585.0
CC(C)[Si](C#Cc1c2ccccc2c(C#Cc2c3ccccc3c(C#Cc3c4ccccc4c(C#Cc4c5ccccc5c(C#Cc5c6ccccc6c(C#Cc6c7ccccc7c(C#C[Si](C(C)C)(C(C)C)C(C)C)c7ccccc67)c6ccccc56)c5ccccc45)c4ccccc34)c3ccccc23)c2ccccc12)(C(C)C)C(C)C,Cc1ccccc1,589.0
CC(C)[Si](C#Cc1c2nc3c(nc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc4c(nc12)C1c2ccccc2C4c2ccccc21)C1c2ccccc2C3c2ccccc21)(C(C)C)C(C)C,CCCCCC,450.0
CC(C)[Si](C#Cc1c2nc3c(nc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc4ccccc4nc12)C1c2ccccc2C3c2ccccc21)(C(C)C)C(C)C,CCCCCC,551.0
CC(C)[Si](C#Cc1c2nc3ccccc3nc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(ccc4cc5ccccc5cc43)nc12)(C(C)C)C(C)C,CCCCCC,638.0
CC(C)[Si](C#Cc1c2nc3ccccc3nc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(ccc4ccccc43)nc12)(C(C)C)C(C)C,CCCCCC,649.0
CC(C)[Si](C#Cc1c2nc3ccccc3nc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c4ccccc4c(=O)c4ccccc4c3nc12)(C(C)C)C(C)C,ClCCl,603.0
CC(C)[Si](C#Cc1c2nc3ccccc3nc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3ccccc3nc12)(C(C)C)C(C)C,CCCCCC,681.0
CC(C)[Si](C#Cc1c2nsnc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(ccc4ccccc43)nc12)(C(C)C)C(C)C,CCCCCC,607.0
CC(C)[Si](C#Cc1c2nsnc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)C1c2ccccc2C3c2ccccc21)(C(C)C)C(C)C,CCCCCC,511.0
CC(C)[Si](C#Cc1c2nsnc2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)Cc1ccccc1-3)(C(C)C)C(C)C,CCCCCC,540.0
CC(C)[Si](C#Cc1cc2c(=S)c3cc(C#C[Si](C(C)C)(C(C)C)C(C)C)cc4c(=S)c5cc(C#C[Si](C(C)C)(C(C)C)C(C)C)cc6c(=S)c(c1)c2n(c34)c65)(C(C)C)C(C)C,ClCCl,577.0
CC(C)[Si](C#Cc1cc2c3c(c1)c(=C(c1ccccc1)c1ccccc1)c1cc(C#C[Si](C(C)C)(C(C)C)C(C)C)cc4c1-n-3-c1c(cc(C#C[Si](C(C)C)(C(C)C)C(C)C)cc1c4=C(c1ccccc1)c1ccccc1)c2=C(c1ccccc1)c1ccccc1)(C(C)C)C(C)C,ClCCl,404.0
CC(C)[Si](C#Cc1cc2c3c(c1)c(=C1c4ccccc4Sc4ccccc41)c1cc(C#C[Si](C(C)C)(C(C)C)C(C)C)cc4c1-n-3-c1c(cc(C#C[Si](C(C)C)(C(C)C)C(C)C)cc1c4=C1c3ccccc3Sc3ccccc31)c2=C1c2ccccc2Sc2ccccc21)(C(C)C)C(C)C,ClCCl,428.0
CC(C)[Si](C#Cc1ccc(-c2c3cccc4c5cccc6c(-c7ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)cc7)c7cccc8c9cccc2c9c(c34)c(c65)c78)cc1)(C(C)C)C(C)C,Cc1ccccc1,727.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(ccc4cc5ccccc5cc43)nc12)(C(C)C)C(C)C,CCCCCC,463.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(ccc4ccccc43)nc12)(C(C)C)C(C)C,CCCCCC,411.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)C1c2ccccc2C3c2ccccc21)(C(C)C)C(C)C,CCCCCC,349.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3c(nc12)Cc1ccccc1-3)(C(C)C)C(C)C,CCCCCC,369.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3cc4c(cc3nc12)[C@H]1c2ccccc2[C@@H]4c2ccccc21)(C(C)C)C(C)C,CCCCCC,435.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3cc4c(cc3nc12)[C@H]1c2ccccc2[C@@H]4c2ccccc21)(C(C)C)C(C)C,ClCCl,435.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3ccccc3nc12)(C(C)C)C(C)C,CCCCCC,440.0
CC(C)[Si](C#Cc1ccc(C#C[Si](C(C)C)(C(C)C)C(C)C)c2nc3ccccc3nc12)(C(C)C)C(C)C,ClCCl,439.0
CC(C)[Si](C#Cc1ccc(C#Cc2c3cc4ccccc4cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc4ccccc4cc23)cc1)(C(C)C)C(C)C,ClCCl,659.0
CC(C)[Si](c1cc(/C=C(/C#N)C(=O)O)c(-c2cc3c(s2)-c2sc(-c4sc([Si](C(C)C)(C(C)C)C(C)C)cc4/C=C(\C#N)C(=O)O)cc2C32c3ccc(-c4ccc(C(C)(C)C)cc4)cc3-c3cc(-c4ccc(C(C)(C)C)cc4)ccc32)s1)(C(C)C)C(C)C,C1CCOC1,490.0
CC(C)[Si](c1cc(/C=C(\C#N)C(=O)O)c(-c2cc3c(s2)-c2sc(-c4sc([Si](C(C)C)(C(C)C)C(C)C)cc4/C=C(\C#N)C(=O)O)cc2C32c3ccc(-c4ccc(C(C)(C)C)cc4)cc3-c3cc(-c4ccc(C(C)(C)C)cc4)ccc32)s1)(C(C)C)C(C)C,C1CCOC1,490.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(C)C)cc21,C1CCCCC1,357.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(C)C)cc21,CC#N,360.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(C)C)cc21,CCO,360.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(C)C)cc21,CCOCC,358.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(C)C)cc21,CS(C)=O,375.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(C)C)cc21,ClCCl,368.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(C)C)cc21,c1ccccc1,360.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,391.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,381.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCO,385.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCOCC,383.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CS(C)=O,387.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,388.0
CC(C)[Si]1(C(C)C)c2cc(C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,c1ccccc1,389.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(C)C)cc21,C1CCCCC1,480.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(C)C)cc21,CC#N,475.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(C)C)cc21,CCO,478.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(C)C)cc21,CCOCC,469.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(C)C)cc21,CS(C)=O,488.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(C)C)cc21,ClCCl,489.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(C)C)cc21,c1ccccc1,480.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,484.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,461.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCO,467.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCOCC,467.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CS(C)=O,466.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,481.0
CC(C)[Si]1(C(C)C)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,c1ccccc1,477.0
CC(C)[Si]1(C(C)C)c2cc(C=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,403.0
CC(C)[Si]1(C(C)C)c2cc(C=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,392.0
CC(C)[Si]1(C(C)C)c2cc(C=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCO,396.0
CC(C)[Si]1(C(C)C)c2cc(C=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCOCC,393.0
CC(C)[Si]1(C(C)C)c2cc(C=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CS(C)=O,398.0
CC(C)[Si]1(C(C)C)c2cc(C=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,401.0
CC(C)[Si]1(C(C)C)c2cc(C=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,c1ccccc1,398.0
CC(C)[Si]1(C(C)C)c2cc(N(C)C)ccc2-c2ccc(C(F)(F)F)cc21,C1CCCCC1,331.0
CC(C)[Si]1(C(C)C)c2cc(N(C)C)ccc2-c2ccc(C(F)(F)F)cc21,CC#N,337.0
CC(C)[Si]1(C(C)C)c2cc(N(C)C)ccc2-c2ccc(C(F)(F)F)cc21,CCO,335.0
CC(C)[Si]1(C(C)C)c2cc(N(C)C)ccc2-c2ccc(C(F)(F)F)cc21,CCOCC,334.0
CC(C)[Si]1(C(C)C)c2cc(N(C)C)ccc2-c2ccc(C(F)(F)F)cc21,CS(C)=O,344.0
CC(C)[Si]1(C(C)C)c2cc(N(C)C)ccc2-c2ccc(C(F)(F)F)cc21,ClCCl,338.0
CC(C)[Si]1(C(C)C)c2cc(N(C)C)ccc2-c2ccc(C(F)(F)F)cc21,c1ccccc1,338.0
CC(C)[Si]1(C(C)C)c2ccccc2-c2ccc(N(C)C)cc21,C1CCCCC1,323.0
CC(C)[Si]1(C(C)C)c2ccccc2-c2ccc(N(C)C)cc21,CC#N,321.0
CC(C)[Si]1(C(C)C)c2ccccc2-c2ccc(N(C)C)cc21,CCO,319.0
CC(C)[Si]1(C(C)C)c2ccccc2-c2ccc(N(C)C)cc21,CCOCC,318.0
CC(C)[Si]1(C(C)C)c2ccccc2-c2ccc(N(C)C)cc21,CS(C)=O,324.0
CC(C)[Si]1(C(C)C)c2ccccc2-c2ccc(N(C)C)cc21,ClCCl,323.0
CC(C)[Si]1(C(C)C)c2ccccc2-c2ccc(N(C)C)cc21,c1ccccc1,323.0
CC(C)c1cc(C(C)C)c(-c2ccc(-n3c4ccccc4n4c5ccccc5nc34)nc2)c(C(C)C)c1,Cc1ccccc1,345.0
CC(C)c1cc(C(C)C)c(-c2nnc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)o2)c(C(C)C)c1,Cc1ccccc1,340.0
CC(C)c1cc(C(C)C)c(B2c3cc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)ccc3N(c3ccccc3)c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)cc32)c(C(C)C)c1,C1CCCCC1,410.5442177
CC(C)c1cc(C(C)C)c(B2c3cc(-n4c5ccccc5c5ccccc54)ccc3N(c3ccccc3)c3ccc(-n4c5ccccc5c5ccccc54)cc32)c(C(C)C)c1,C1CCCCC1,400.0
CC(C)c1cc(C(C)C)c(B2c3cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc3N(c3ccccc3)c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc32)c(C(C)C)c1,C1CCCCC1,374.829932
CC(C)c1cc(C(C)C)c(B2c3cc(N4c5ccccc5Oc5ccccc54)ccc3N(c3ccccc3)c3ccc(N4c5ccccc5Oc5ccccc54)cc32)c(C(C)C)c1,C1CCCCC1,372.7891156
CC(C)c1cc(C(C)C)c(B2c3ccccc3Oc3cc(-n4c5ccccc5c5c6c(c7ccccc7n6-c6ccccc6)c6c(c7ccccc7n6-c6ccccc6)c54)ccc32)c(C(C)C)c1,Cc1ccccc1,458.0
CC(C)c1cc(C(C)C)c(B2c3ccccc3Oc3cc(-n4c5ccccc5c5ccc6c(c7ccccc7n6-c6ccccc6)c54)ccc32)c(C(C)C)c1,Cc1ccccc1,438.0
CC(C)c1cc(C(C)C)c(B2c3ccccc3Oc3cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc32)c(C(C)C)c1,Cc1ccccc1,436.0
CC(C)c1cc(C(C)C)c(B2c3ccccc3Oc3cc(N4c5ccccc5C5(c6ccccc6-c6ccccc65)c5ccccc54)ccc32)c(C(C)C)c1,Cc1ccccc1,430.0
CC(C)c1cc(C(C)C)c(B2c3ccccc3Oc3cc(N4c5ccccc5C5(c6ccccc6Oc6ccccc65)c5ccccc54)ccc32)c(C(C)C)c1,Cc1ccccc1,429.0
CC(C)c1cc(N(C)C)c(C#N)c2c1-c1cccc3cccc-2c13,O,430.0
CC(C)c1cc(S(=O)(=O)O)cc(C(C)C)c1N=Cc1cc(N=Nc2ccc([N+](=O)[O-])cc2)ccc1O,ClC(Cl)Cl,380.0
CC(C)c1ccc(-c2cc3c(o2)=CC2=Cc4cc5oc(-c6ccc(C(C)C)cc6)cc5n4[B-](F)(F)[N+]=32)cc1,ClC(Cl)Cl,662.0
CC(C)c1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,CC#N,380.0
CC(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3s2)cc1,C1CCCCC1,388.0
CC(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3s2)cc1,CC#N,392.0
CC(C)c1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,430.0
CC(C)c1ccc(C2C3=C(CC(C)(C)CC3=O)Oc3ccc4ccc(OCCCNCCCNc5ccnc6cc(Cl)ccc56)cc4c32)cc1,CO,333.0
CC(C)c1ccc(C=Cc2ccc3c4c(ccc3c2)OC(c2ccccc2)(c2ccccc2)C4=C=C(c2ccccc2)c2ccccc2)cc1,C1CCOC1,467.0
CC(C)c1ccc(N=Cc2cc(N=Nc3ccccc3)ccc2O)cc1,CS(C)=O,240.0
CC(C)c1ccc2ccc3cccc4ccc1c2c34,CCCCCC,338.0
CC(C)c1ccc2ccc3cccc4ccc1c2c34,CO,337.0
CC(C)c1ccc2ccc3cccc4ccc1c2c34,ClCCl,340.0
CC(C)c1cccc(-[n+]2nc3cc(C(C)C)ccc3c3ccccc32)c1,ClCCl,438.0
CC(C)c1cccc(C(C)C)c1-n1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)s2)ccc1-c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1,C1CCOC1,455.0
CC(C)c1cccc(C(C)C)c1-n1c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)cc(/C=C(\C#N)C(=O)O)c1-c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1,C1CCOC1,418.0
CC(C)c1cccc(C(C)C)c1-n1c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)ccc1-c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)c(F)c2)s1,C1CCOC1,423.0
CC(C)c1cccc(C(C)C)c1-n1c(=O)c2cc3nc(-c4ccccc4)c4cc5c(=O)n(-c6c(C(C)C)cccc6C(C)C)c(=O)c6cc7c(-c8ccccc8)nc8cc(c1=O)c2c1c3c4c(c56)c7c81,ClC(Cl)Cl,480.0
CC(C)c1cccc(C(C)C)c1-n1c(=O)c2cc3nc(-c4ccccc4)c4cc5c(=O)n(-c6c(C(C)C)cccc6C(C)C)c(=O)c6cc7nc(-c8ccccc8)c8cc(c1=O)c2c1c3c4c(c65)c7c81,ClC(Cl)Cl,488.0
CC(C)c1cccc(C(C)C)c1-n1c(=O)c2ccc3c4ccc5c(=O)n(-c6c(C(C)C)cccc6C(C)C)c(=O)c6cc7c(-c8ccccc8)nc8cc(c1=O)c2c3c8c7c4c56,ClC(Cl)Cl,476.0
CC(C)c1cccc(C(C)C)c1-n1c(=O)c2ccc3c4ccc5c(=O)n(-c6c(C(C)C)cccc6C(C)C)c(=O)c6cc7c(-c8ccccn8)nc8cc(c1=O)c2c3c8c7c4c56,ClC(Cl)Cl,474.0
CC(C)c1cccc(C(C)C)c1N1B(c2ccc(B3N(c4c(C(C)C)cccc4C(C)C)C(c4ccc(C(F)(F)F)cc4)=C(c4ccc(C(F)(F)F)cc4)N3c3c(C(C)C)cccc3C(C)C)cc2)N(c2c(C(C)C)cccc2C(C)C)C(c2ccc(C(F)(F)F)cc2)=C1c1ccc(C(F)(F)F)cc1,C1CCOC1,439.0
CC(C)c1cccc(C(C)C)c1N1B(c2ccccc2)N(c2c(C(C)C)cccc2C(C)C)C(c2ccccc2)=C1c1ccccc1,C1CCOC1,406.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2cc(Cl)c3c4c(Cl)cc5c6c(cc(Cl)c(c7c(Cl)cc(c2c37)C1=O)c64)C(=O)N(c1c(C(C)C)cccc1C(C)C)C5=O,Cc1ccccc1,523.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)C)cc7)c(c7c(Oc8ccc(C(C)(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)N(c1c(C(C)C)cccc1C(C)C)C5=O,Cc1ccccc1,581.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2cc(Oc3ccccc3)c3c4c(Oc5ccccc5)cc5c6c(cc(Oc7ccccc7)c(c7c(Oc8ccccc8)cc(c2c37)C1=O)c64)C(=O)OC5=O,ClCCl,576.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc3c(-c4ccc(C(=O)O)cc4)c4c5ccc6c7c(ccc(c(-c8ccc(C(=O)O)cc8)c4c4ccc(c2c34)C1=O)c75)C(=O)N(c1c(C(C)C)cccc1C(C)C)C6=O,ClCCl,622.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc3c(-c4ccccc4)c4c5ccc6c7c(ccc(c(-c8ccccc8)c4c4ccc(c2c34)C1=O)c75)C(=O)N(c1c(C(C)C)cccc1C(C)C)C6=O,ClCCl,631.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc3c4c(-c5ccc(C(=O)O)cc5)c5ccc6c7c(cc8c9cc(C(=O)O)ccc9c(c9ccc(c2c39)C1=O)c4c8c57)C(=O)N(c1c(C(C)C)cccc1C(C)C)C6=O,ClCCl,607.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc3c4c(=O)n5c(c=4c4ccc(c2c34)C1=O)=c1c2c3ccc4c6c(ccc(c=2c(=O)n1C5)c63)C(=O)N(c1c(C(C)C)cccc1C(C)C)C4=O,Cc1ccccc1,688.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)OC5=O,Cc1ccccc1,523.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2ccc3cc4c(cc5ccc6c7c(ccc4c57)C(=O)N(c4c(C(C)C)cccc4C(C)C)C6=O)c4ccc(c2c34)C1=O,ClCCl,648.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc3c(Oc4ccc(C(C)(C)C)cc4)ccc(c23)C1=O,ClCCl,364.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc3c(Oc4ccc(C(C)(C)c5ccccc5)cc4)ccc(c23)C1=O,ClCCl,365.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc3c(Oc4ccc(Cl)cc4)ccc(c23)C1=O,ClCCl,360.0
CC(C)c1cccc(C(C)C)c1N1C(=O)c2cccc3c(Oc4ccccc4)ccc(c23)C1=O,ClCCl,364.0
CC(C)c1cccc(C(C)C)c1N1C(c2ccccc2)=Cc2ccc3ccccc3[n+]2[B-]1(F)F,ClCCl,447.0
CC(C)c1cccc(C(C)C)c1[N+]1=Cc2cccn2[B-]1(c1ccccc1)c1ccccc1,C1CCOC1,353.2763532763533
CC(C)c1ccccc1-c1cc2c(o1)=CC1=Cc3cc4oc(-c5ccccc5C(C)C)cc4n3[B-](F)(F)[N+]=21,ClC(Cl)Cl,629.0
CC(C)n1c2cc(O)c(F)cc2c(=O)c2cc(F)c(O)cc21,CCO,379.0
CC(C)n1nc(/C=C/c2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,CC#N,367.0
CC(C)n1nc(/C=C/c2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,Cc1ccccc1,367.0
CC(C)n1nc(/C=C/c2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,O,356.0
CC(C)n1nc(C#Cc2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,CC#N,348.0
CC(C)n1nc(C#Cc2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,Cc1ccccc1,349.0
CC(C)n1nc(C#Cc2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,O,350.0
CC(C)n1nc(CCc2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,CC#N,360.0
CC(C)n1nc(CCc2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,Cc1ccccc1,359.0
CC(C)n1nc(CCc2ccc3cc(N(C)C)ccc3c2)c2c(N)ncnc21,O,341.0
CC(CO)N1Cc2c(-c3ccc(N(C)C)cc3)c3cc(-c4ccccc4)ccn3c2C1=O,ClCCl,403.0
CC(CO)N1Cc2c(-c3ccc(N(C)C)cc3)c3cc(C#N)ccn3c2C1=O,ClCCl,428.0
CC(CO)N1Cc2c(-c3ccc(N(C)C)cc3)c3ccccn3c2C1=O,ClCCl,298.0
CC(CO)N1Cc2c(-c3ccccc3)c3ccccn3c2C1=O,ClCCl,298.0
CC(CO)N1Cc2c(-c3cccs3)c3cc(-c4ccccc4)ccn3c2C1=O,ClCCl,283.0
CC(CO)N1Cc2c(-c3cccs3)c3ccccn3c2C1=O,ClCCl,322.0
CC(Cc1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)sc2c1sc1c3sc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c(CC(C)CC(C)(C)C)c3sc21)CC(C)(C)C,Clc1ccccc1Cl,485.0
CC(Cc1ccccc1)NC(C#N)c1ccccc1,CCO,495.0
CC(N)=O,O,220.0
CC(O)CC1=N/C(=C\c2cccc(N(C)C)c2)C(=O)N1C,C1CCOC1,356.0
CC(O)CC1=N/C(=C\c2cccc(N(C)C)c2)C(=O)N1C,CC#N,355.0
CC(O)CC1=N/C(=C\c2cccc(N(C)C)c2)C(=O)N1C,CCCCCC,352.0
CC(Oc1ccccc1)C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,430.0
CC(c1ccc(OCCCCCCN2c3ccccc3Sc3cc(/C=C(/C#N)C(=O)O)ccc32)cc1)(c1ccc(OCCCCCCN2c3ccccc3Sc3cc(/C=C(/C#N)C(=O)O)ccc32)cc1)c1ccc(OCCCCCCN2c3ccccc3Sc3cc(/C=C(\C#N)C(=O)O)ccc32)cc1,CN(C)C=O,410.0
CC(c1ccccc1)c1nn(-c2ccccc2)nc1-c1ccccc1,CO,285.0
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,C1COCCO1,317.3
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,CCCCCC,313.5
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,CCCCCCCCCC,315.3
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,CCCCO,315.2
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,CCO,313.8
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,CCOCC,313.5
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,CO,313.0
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,ClC(Cl)Cl,319.6
CC/C=C/C=C/C=C/C=C/CCCCCCCC(=O)O,c1ccccc1,320.0
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,C1COCCO1,322.7
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,CCCCCC,318.9
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,CCCCCCCCCC,320.8
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,CCCCO,320.6
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,CCO,319.2
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,CCOCC,318.8
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,CO,318.6
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,ClC(Cl)Cl,324.8
CC/C=C\C=C\C=C\C=C/CCCCCCCC(=O)O,c1ccccc1,325.3
CC/[NH+]=c1/cc2oc3c(ccc4cc(O)ccc43)c(-c3ccccc3C(=O)O)c-2cc1C,O,522.0
CC/[NH+]=c1/cc2oc3cc4c(cc3c(-c3ccccc3C(=O)[O-])c-2cc1C)N(CC)C1CCCCC1N4CC,CCO,570.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NC(C(=O)OC)C(C)C)c4ccccc4c3nc-2cc1C,CCO,590.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NC(C(=O)OC)C(C)C)c4ccccc4c3nc-2cc1C,O,580.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NC(C(=O)OC)c4ccccc4)c4ccccc4c3nc-2cc1C,CCO,580.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NC(C(=O)OC)c4ccccc4)c4ccccc4c3nc-2cc1C,O,590.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NC(C)C(=O)OC)c4ccccc4c3nc-2cc1C,CCO,590.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NC(CCC(=O)OC)C(=O)OC)c4ccccc4c3nc-2cc1C,CCO,600.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NC(CCC(=O)OC)C(=O)OC)c4ccccc4c3nc-2cc1C,O,600.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NCC(=O)OC)c4ccccc4c3nc-2cc1C,CCO,600.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NCC(=O)OC)c4ccccc4c3nc-2cc1C,O,590.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NCCCCC(NC(C)=O)C(=O)OC)c4ccccc4c3nc-2cc1C,CCO,590.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)NCCCCC(NC(C)=O)C(=O)OC)c4ccccc4c3nc-2cc1C,O,590.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)O)c4ccccc4c3nc-2cc1C,CCO,590.0
CC/[NH+]=c1\cc2oc3cc(NCCC(=O)O)c4ccccc4c3nc-2cc1C,O,580.0
CC/[NH+]=c1\cc2oc3cc(NCCN)c4ccccc4c3nc-2cc1C,CCO,590.0
CC/[NH+]=c1\cc2oc3cc(NCCN)c4ccccc4c3nc-2cc1C,O,590.0
CC/[NH+]=c1\cc2oc3cc(NCCOC(=O)C(NC(=O)OC(C)(C)C)C(C)C)c4ccccc4c3nc-2cc1C,CCO,590.0
CC/[NH+]=c1\cc2oc3cc(NCCOC(=O)C(NC(=O)OC(C)(C)C)C(C)C)c4ccccc4c3nc-2cc1C,O,590.0
CC1(C)/C(=C\C2C(=C(C#N)C#N)C(=O)C2[O-])N(CCC(=O)O)c2ccc(C(=O)O)cc21,CCO,459.0
CC1(C)/C(=C\C2C(=C(C#N)C#N)C(=O)C2[O-])N(CCC(=O)O)c2ccc3ccccc3c21,CCO,467.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3/N(CCCCCC(=O)O)c4ccccc4C3(C)C)CCC2)=[N+](CCCCCC(=O)O)c2ccccc21,CO,782.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3/N(CCCCS(=O)(=O)[O-])c4ccc5ccccc5c4C3(C)C)CCC2)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21,CO,820.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccccc4C3(C)C)CCC2)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CO,778.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3/N(Cc4ccc(C(=O)O)cc4)c4ccccc4C3(C)C)CCC2)=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,CO,786.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3/N(Cc4ccc(F)cc4)c4ccccc4C3(C)C)CCC2)=[N+](Cc2ccc(F)cc2)c2ccccc21,CO,784.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3/N(Cc4ccc([N+](=O)[O-])cc4)c4ccccc4C3(C)C)CCC2)=[N+](Cc2ccc([N+](=O)[O-])cc2)c2ccccc21,CO,785.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3/N(Cc4ccccc4)c4ccccc4C3(C)C)CCC2)=[N+](Cc2ccccc2)c2ccccc21,CO,784.0
CC1(C)C(/C=C/C2=C(Cl)/C(=C/C=C3\N(CCC(=O)O)c4ccc5ccccc5c4C3(C)C)CCC2)=[N+](CCC(=O)[O-])c2ccc3ccccc3c21,CCO,830.0
CC1(C)C(/C=C/C2=C(Oc3ccc(CCN=C=S)cc3)/C(=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccccc4C3(C)C)CCC2)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CO,765.0
CC1(C)C(/C=C/C2=C(Oc3ccc(CCN=C=S)cc3Cl)/C(=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccccc4C3(C)C)CCC2)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CO,768.0
CC1(C)C(/C=C/C2=C(Oc3ccc(CCN=C=S)cc3F)/C(=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccccc4C3(C)C)CCC2)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CO,768.0
CC1(C)C(/C=C/C2=C(Oc3ccc(CCN=C=S)cc3I)/C(=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccccc4C3(C)C)CCC2)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CO,766.0
CC1(C)C(/C=C/C2=C(Oc3ccc(S(=O)(=O)[O-])cc3)/C(=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccccc4C3(C)CCCC(=O)O)CCC2)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CCO,777.0
CC1(C)C(/C=C/C2=C(c3ccc(C(=O)O)cc3)/C(=C/C=C3/N(CCCCS(=O)(=O)[O-])c4ccc5ccccc5c4C3(C)C)CCC2)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21,CO,800.0
CC1(C)C(/C=C/C2=C(c3ccc(C(=O)O)cc3)/C(=C/C=C3/N(CCCCS(=O)(=O)[O-])c4ccccc4C3(C)C)CC2)=[N+](CCCCS(=O)(=O)[O-])c2ccccc21,CO,797.0
CC1(C)C(/C=C/C2=C(c3ccc(C(=O)O)cc3)/C(=C/C=C3/N(CCCCS(=O)(=O)[O-])c4ccccc4C3(C)C)CCC2)=[N+](CCCCS(=O)(=O)[O-])c2ccccc21,CO,765.0
CC1(C)C(/C=C/C2=C(c3ccc(C(=O)O)cc3)/C(=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccc5ccccc5c4C3(C)C)CCC2)=[N+](CCCS(=O)(=O)[O-])c2ccc3ccccc3c21,CO,800.0
CC1(C)C(/C=C/C=C/C=C/C=C2/N(CCC(=O)O)c3ccc4ccccc4c3C2(C)C)=[N+](CCC(=O)O)c2ccc3ccccc3c21,CO,792.0
CC1(C)C(/C=C/C=C/C=C/C=C2/N(CCCCS(=O)(=O)[O-])c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21,CO,792.0
CC1(C)C(/C=C/C=C/C=C/C=C2/N(S(=O)(=O)[O-])c3ccc(S(=O)(=O)[O-])cc3C2(C)C)=[N+](S(=O)(=O)[O-])c2ccc(S(=O)(=O)[O-])cc21,CO,755.0
CC1(C)C(/C=C/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)O)cc21,CCO,508.0
CC1(C)C(/C=C/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)O)cc21,CS(C)=O,494.0
CC1(C)C(/C=C/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)O)cc21,O,592.0
CC1(C)C(/C=C/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CS(C)=O,491.0
CC1(C)C(/C=C/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,O,564.0
CC1(C)C(/C=C/C=C2/N(Cc3ccc(C(=O)O)cc3)c3ccccc3C2(C)C)=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,CC#N,550.0
CC1(C)C(/C=C/C=C2/N(Cc3ccc(C(=O)O)cc3)c3ccccc3C2(C)C)=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,CCO,560.0
CC1(C)C(/C=C/C=C2/N(Cc3ccc(C(=O)O)cc3)c3ccccc3C2(C)C)=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,CO,554.0
CC1(C)C(/C=C/C=C2/N(Cc3ccc(C(=O)O)cc3)c3ccccc3C2(C)C)=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,ClC(Cl)Cl,561.0
CC1(C)C(/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)O)cc21,CCO,630.0
CC1(C)C(/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)O)cc21,CS(C)=O,485.0
CC1(C)C(/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)O)cc21,O,573.0
CC1(C)C(/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CCO,623.0
CC1(C)C(/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,CS(C)=O,630.0
CC1(C)C(/C=C/c2cc3ccc(O)cc3oc2=O)=[N+](CCCS(=O)(=O)[O-])c2ccccc21,O,555.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(CC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CC(=O)O)c2ccccc21,C1CCOC1,636.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(CC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CC(=O)O)c2ccccc21,CN(C)C=O,637.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(CC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CC(=O)O)c2ccccc21,CO,620.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(CC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CC(=O)O)c2ccccc21,CS(C)=O,647.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(CC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CC(=O)O)c2ccccc21,Cc1ccccc1,638.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(CC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CC(=O)O)c2ccccc21,c1ccccc1,639.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(Cc4ccc(C(=O)O)cc4)c4ccccc4C3(C)C)=C2[O-])=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,CC#N,634.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(Cc4ccc(C(=O)O)cc4)c4ccccc4C3(C)C)=C2[O-])=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,CCO,636.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(Cc4ccc(C(=O)O)cc4)c4ccccc4C3(C)C)=C2[O-])=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,CO,632.0
CC1(C)C(/C=C2\C(=O)C(/C=C3/N(Cc4ccc(C(=O)O)cc4)c4ccccc4C3(C)C)=C2[O-])=[N+](Cc2ccc(C(=O)O)cc2)c2ccccc21,ClC(Cl)Cl,637.0
CC1(C)C(/C=C2\C(=O)C(/C=C3\N(CCC(=O)O)c4cc5ccccc5cc4C3(C)C)=C2[O-])=[N+](CCC(=O)O)c2ccc3ccccc3c21,CCO,679.0
CC1(C)C(/C=C2\C(=O)C(/C=C3\N(CCCC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CCCC(=O)O)c2ccccc21,CO,642.0
CC1(C)C(/C=C2\C(=O)C(/C=C3\N(CCCCCC(=O)O)c4ccccc4C3(C)C)=C2[O-])=[N+](CCCCCC(=O)O)c2ccccc21,CO,649.0
CC1(C)C(/C=C2\C(=O)C(/C=C3\N(CCCCS(=O)(=O)[O-])c4ccc(Br)cc4C3(C)C)=C2[O-])=[N+](CCCCS(=O)(=O)[O-])c2ccc(Br)cc21,CO,654.0
CC1(C)C(/C=C2\C(=O)C(/C=C3\Nc4ccccc4C3(C)C)=C2[O-])=[NH+]c2ccccc21,ClC(Cl)Cl,654.0
CC1(C)C(=O)C=Cc2ccc(N)cc21,O,377.0
CC1(C)C(=O)C=Cc2ccc(N3CCC3)cc21,O,387.0
CC1(C)C(c2ccc(/C=C(\C#N)C(=O)O)cc2)=Nc2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,435.0
CC1(C)C(c2ccc(/C=C(\C#N)C(=O)O)s2)=Nc2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,464.0
CC1(C)C(c2ncc(/C=C(\C#N)C(=O)O)s2)=Nc2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,480.0
CC1(C)C/C(=C(/C#N)C(=O)O)CC(/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)C1,ClCCl,476.0
CC1(C)C/C(=C(/C#N)C(=O)O)CC(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)C1,ClCCl,478.0
CC1(C)C/C(=C(/C#N)C(=O)O)C[C@@H](/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)C1,ClCCl,476.0
CC1(C)C/C(=C(/C#N)C(=O)O)C[C@@H](/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)C1,ClCCl,478.0
CC1(C)C/C2=C(\C#Cc3ccc(C(=O)O)cc3)c3ccc([nH]3)/C(c3ccccc3)=C3\NC(/C=c4/cc/c([nH]4)=C(\c4ccccc4)C1=N2)CC3(C)C,C1CCOC1,745.0
CC1(C)C2=C(C=C(C#N)C#N)CCCN2c2ccccc21,CCCCCC,449.0
CC1(C)C2=C(C=CC=C(C#N)C#N)CCCN2c2ccccc21,CCO,538.0
CC1(C)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)P(=O)(c1ccccc1)c1ccccc12,CC#N,412.0
CC1(C)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)P(=O)(c1ccccc1)c1ccccc12,CO,424.0
CC1(C)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)P(=O)(c1ccccc1)c1ccccc12,Cc1ccccc1,418.0
CC1(C)C2=C(c3ccccc31)S(=O)(=O)c1ccccc12,ClCCl,355.0
CC1(C)C2=C3C=C4C5=[N+](CCC4OC3CCN2c2ccc(CC(=O)NCCCCCCO)cc21)c1ccc(S(=O)(=O)[O-])cc1C5(C)C,O,558.0
CC1(C)C2=CC(=[N+]3CCCC3)C=CC2=C(c2ccccc2C(=O)[O-])c2ccc(N3CCCC3)cc21,O,613.0
CC1(C)C2=[N+](CCCCCC(=O)NCCCNC(=O)CCCCCN3/C(=C/C=C/C=C/C=C/2)C(C)(C)c2cc(S(=O)(=O)[O-])ccc23)c2ccc(S(=O)(=O)[O-])cc21,CO,754.0
CC1(C)C2=[N+](CCCCCC(=O)NCCCNC(=O)CCCCCN3/C(=C/C=C/C=C/C=C/2)C(C)(C)c2cc(S(=O)(=O)[O-])ccc23)c2ccc(S(=O)(=O)[O-])cc21,O,749.0
CC1(C)C2=[N+](CCCCCC(=O)NCCNC(=O)CCCCCN3/C(=C/C=C/C=C/C=C/2)C(C)(C)c2cc(S(=O)(=O)[O-])ccc23)c2ccc(S(=O)(=O)[O-])cc21,CO,755.0
CC1(C)C2=[N+](CCCCCC(=O)NCCNC(=O)CCCCCN3/C(=C/C=C/C=C/C=C/2)C(C)(C)c2cc(S(=O)(=O)[O-])ccc23)c2ccc(S(=O)(=O)[O-])cc21,O,750.0
CC1(C)C2=[N+](CCCCCC(=O)NCNC(=O)CCCCCN3/C(=C/C=C/C=C/C=C/2)C(C)(C)c2cc(S(=O)(=O)[O-])ccc23)c2ccc(S(=O)(=O)[O-])cc21,CO,754.0
CC1(C)C2=[N+](c3ccc(Cl)cc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,CO,472.0
CC1(C)C2=[N+](c3ccc(Cl)cc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,CS(C)=O,475.0
CC1(C)C2=[N+](c3ccc(Cl)cc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,Cc1ccccc1,473.0
CC1(C)C2=[N+](c3ccc(Cl)cc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,ClCCl,472.0
CC1(C)C2=[N+](c3ccc(Cl)cc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,O,480.0
CC1(C)C2=[N+](c3ccccc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,CO,465.0
CC1(C)C2=[N+](c3ccccc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,CS(C)=O,468.0
CC1(C)C2=[N+](c3ccccc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,Cc1ccccc1,469.0
CC1(C)C2=[N+](c3ccccc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,ClCCl,469.0
CC1(C)C2=[N+](c3ccccc31)[B-](F)(F)n1cccc1-c1c2cc2n1CC=C2,O,465.0
CC1(C)C=C(CS(=O)(=O)O)c2cc3c(-c4ccc(C(=O)O)cc4C(=O)O)c4cc5c(cc4[o+]c3cc2N1CCCS(N)(=O)=O)N(CCCS(N)(=O)=O)C(C)(C)C=C5CS(=O)(=O)O,O,594.0
CC1(C)C=C(CS(=O)(=O)O)c2cc3cc(C(=O)NCCCCCC(=O)O)c(=O)oc3cc2N1CCCS(=O)(=O)O,O,442.0
CC1(C)C=C(CS(=O)(=O)[O-])c2cc3cc(C(=O)NCCCCCC(=O)O)c(=O)oc3cc2N1CCCS(=O)(=O)O,O,442.0
CC1(C)C=C(CS(=O)(=O)[O-])c2cc3cc(C(=O)NCCCCCC(=O)O)c(=O)oc3cc2N1CCCS(=O)(=O)[O-],O,442.0
CC1(C)CC(/C=C/c2cc3cc4c5c(c3oc2=O)C(C)(C)CCN5CCC4(C)C)=C/C(=C(/C#N)C(=O)O)C1,CCO,492.0
CC1(C)CC(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)=CC(=C(C#N)C#N)C1,C1CCOC1,408.0
CC1(C)CC(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)=CC(=C(C#N)C#N)C1,CC#N,405.0
CC1(C)CC(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)=CC(=C(C#N)C#N)C1,CCO,414.0
CC1(C)CC(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)=CC(=C(C#N)C#N)C1,CCOC(C)=O,407.0
CC1(C)CC(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)=CC(=C(C#N)C#N)C1,ClCCl,410.0
CC1(C)CC(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)=CC(=C(C#N)C#N)C1,c1ccccc1,422.0
CC1(C)CC(/C=C/c2ccc(-n3cccn3)cc2)=CC(=C(C#N)C#N)C1,C1CCOC1,405.0
CC1(C)CC(/C=C/c2ccc(-n3cccn3)cc2)=CC(=C(C#N)C#N)C1,CC#N,397.0
CC1(C)CC(/C=C/c2ccc(-n3cccn3)cc2)=CC(=C(C#N)C#N)C1,CCO,404.0
CC1(C)CC(/C=C/c2ccc(-n3cccn3)cc2)=CC(=C(C#N)C#N)C1,CCOC(C)=O,403.0
CC1(C)CC(/C=C/c2ccc(-n3cccn3)cc2)=CC(=C(C#N)C#N)C1,ClCCl,404.0
CC1(C)CC(/C=C/c2ccc(-n3cccn3)cc2)=CC(=C(C#N)C#N)C1,c1ccccc1,407.0
CC1(C)CC(/C=C/c2ccc(-n3ccnc3)cc2)=CC(=C(C#N)C#N)C1,C1CCOC1,398.0
CC1(C)CC(/C=C/c2ccc(-n3ccnc3)cc2)=CC(=C(C#N)C#N)C1,CC#N,390.0
CC1(C)CC(/C=C/c2ccc(-n3ccnc3)cc2)=CC(=C(C#N)C#N)C1,CCO,391.0
CC1(C)CC(/C=C/c2ccc(-n3ccnc3)cc2)=CC(=C(C#N)C#N)C1,CCOC(C)=O,390.0
CC1(C)CC(/C=C/c2ccc(-n3ccnc3)cc2)=CC(=C(C#N)C#N)C1,ClCCl,393.0
CC1(C)CC(/C=C/c2ccc(-n3ccnc3)cc2)=CC(=C(C#N)C#N)C1,c1ccccc1,397.0
CC1(C)CC(/C=C/c2ccc(-n3cncn3)cc2)=CC(=C(C#N)C#N)C1,C1CCOC1,394.0
CC1(C)CC(/C=C/c2ccc(-n3cncn3)cc2)=CC(=C(C#N)C#N)C1,CC#N,390.0
CC1(C)CC(/C=C/c2ccc(-n3cncn3)cc2)=CC(=C(C#N)C#N)C1,CCO,392.0
CC1(C)CC(/C=C/c2ccc(-n3cncn3)cc2)=CC(=C(C#N)C#N)C1,CCOC(C)=O,390.0
CC1(C)CC(/C=C/c2ccc(-n3cncn3)cc2)=CC(=C(C#N)C#N)C1,ClCCl,391.0
CC1(C)CC(/C=C/c2ccc(-n3cncn3)cc2)=CC(=C(C#N)C#N)C1,c1ccccc1,395.0
CC1(C)CC(/C=C/c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)=C/C(=C(/C#N)C(=O)O)C1,ClC(Cl)Cl,480.0
CC1(C)CC(/C=C/c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)=C/C(=C(/C#N)C(=O)O)C1,ClC(Cl)Cl,522.0
CC1(C)CC(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)=C/C(=C(\C#N)C(=O)O)C1,CC#N,450.0
CC1(C)CC(/C=C/c2ccc(N3CCOCCOCCOCCOCC3)cc2)=CC(=C(C#N)C#N)C1,C1CCOC1,500.0
CC1(C)CC(/C=C/c2ccc(N3CCOCCOCCOCCOCC3)cc2)=CC(=C(C#N)C#N)C1,CC#N,493.0
CC1(C)CC(/C=C/c2ccc(N3CCOCCOCCOCCOCC3)cc2)=CC(=C(C#N)C#N)C1,CCO,504.0
CC1(C)CC(/C=C/c2ccc(N3CCOCCOCCOCCOCC3)cc2)=CC(=C(C#N)C#N)C1,CCOC(C)=O,496.0
CC1(C)CC(/C=C/c2ccc(N3CCOCCOCCOCCOCC3)cc2)=CC(=C(C#N)C#N)C1,ClCCl,502.0
CC1(C)CC(/C=C/c2ccc(N3CCOCCOCCOCCOCC3)cc2)=CC(=C(C#N)C#N)C1,c1ccccc1,500.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,C1CCOC1,414.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,C1COCCO1,411.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,CCO,415.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,CCOC(C)=O,410.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,CN(C)C=O,421.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,CO,411.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,CS(C)=O,422.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,Cc1ccccc1,413.0
CC1(C)CC(/C=C/c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)=CC(=C(C#N)C#N)C1,ClC(Cl)Cl,415.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,C1CCCCC1,360.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,CC#N,358.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,CO,359.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,ClC(Cl)Cl,361.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],C1CCCCC1,360.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],CC#N,359.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],CO,359.0
CC1(C)CC(/N=C/c2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],ClC(Cl)Cl,362.0
CC1(C)CC(=O)C(=C(O)C=Cc2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)C(=O)C1,CO,483.0
CC1(C)CC(=O)C(=C(O)C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)C(=O)C1,CO,466.0
CC1(C)CC(=O)C(=NNc2ccccc2C(=O)O)C(=O)C1,O,442.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3cc(O)ccc3c1C2c1ccccn1,C1CCOC1,349.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3cc(O)ccc3c1C2c1ccccn1,C1COCCO1,347.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3cc(O)ccc3c1C2c1ccccn1,CC#N,349.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3cc(O)ccc3c1C2c1ccccn1,CCCCCCC,347.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3cc(O)ccc3c1C2c1ccccn1,CCO,349.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3cc(O)ccc3c1C2c1ccccn1,CO,349.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3cc(O)ccc3c1C2c1ccccn1,O,347.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(O)cc3c1C2c1ccccn1,C1CCOC1,335.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(O)cc3c1C2c1ccccn1,C1COCCO1,335.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(O)cc3c1C2c1ccccn1,CC#N,334.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(O)cc3c1C2c1ccccn1,CCCCCCC,276.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(O)cc3c1C2c1ccccn1,CCO,334.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(O)cc3c1C2c1ccccn1,CO,341.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(O)cc3c1C2c1ccccn1,O,274.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(OCCCNCCCNc4ccnc5cc(Cl)ccc45)cc3c1C2c1ccc(C(F)(F)F)cc1,CO,334.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccc(OCCCNCCNc4ccnc5cc(Cl)ccc45)cc3c1C2c1ccc(C(F)(F)F)cc1,CO,329.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccccc3c1C2c1ccccn1,C1CCOC1,275.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccccc3c1C2c1ccccn1,C1COCCO1,274.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccccc3c1C2c1ccccn1,CC#N,275.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccccc3c1C2c1ccccn1,CCCCCCC,274.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccccc3c1C2c1ccccn1,CCO,274.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccccc3c1C2c1ccccn1,CO,275.0
CC1(C)CC(=O)C2=C(C1)Oc1ccc3ccccc3c1C2c1ccccn1,O,264.0
CC1(C)CC(=O)c2c(F)c(F)c(F)c(F)c2N1,CC#N,360.0
CC1(C)CC(=O)c2cc(F)c(F)cc2N1,CC#N,369.0
CC1(C)CC(=O)c2cc(F)c(F)cc2N1,CCO,381.0
CC1(C)CC(=O)c2cc(F)cc(F)c2N1,CC#N,377.0
CC1(C)CC(=O)c2cc(F)cc(F)c2N1,CCO,386.0
CC1(C)CC(=O)c2ccc(F)cc2N1,CCO,368.0
CC1(C)CC(C=Cc2cc(-c3cccs3)c(C=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2cccs2)=CC(=C(C#N)C#N)C1,CN(C)C=O,464.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,C1CCCCC1,374.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,CC#N,374.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,CO,374.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1,ClC(Cl)Cl,389.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],C1CCCCC1,342.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],CC#N,341.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],CO,340.0
CC1(C)CC(NCc2ccc3ccc4cccc5ccc2c3c45)CC(C)(C)N1[O],ClC(Cl)Cl,344.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1c(C(F)(F)C(F)(F)F)cc(=O)oc31,ClCCl,426.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1c(C(F)(F)F)cc(=O)oc31,ClCCl,417.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(-c4ccc(C(=O)O)cc4)cc2)c(=O)oc31,CC#N,420.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(-c4sc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)c5c4OCCO5)s2)c(=O)oc31,C1CCOC1,509.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(-c4sc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5c4OCCO5)s2)c(=O)oc31,C1CCOC1,527.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)s2)c(=O)oc31,C1CCOC1,532.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(/C=C/c4ccc(/C=C(/C#N)C(=O)O)s4)s2)c(=O)oc31,CC#N,525.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(/C=C/c4ccc(/C=C(/C#N)C(=O)O)s4)s2)c(=O)oc31,CCO,525.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccc(C#Cc4ccc(-c5ccc(/C=C(/C#N)C(=O)O)cc5)c5nsnc45)s2)c(=O)oc31,CCO,490.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2cccc(-c4ccc(C(=O)O)cc4)c2)c(=O)oc31,CC#N,414.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2ccccc2-c2ccc(C(=O)O)cc2)c(=O)oc31,CC#N,407.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(-c2nc4ccccc4s2)c(=O)oc31,ClC(Cl)Cl,476.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(/C=C(\C#N)c2ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s2)c(=O)oc31,CCO,552.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(/C=C(\C#N)c2ccc(/C=C(\C#N)C(=O)O)s2)c(=O)oc31,CCO,566.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(/C=C/C(=O)O)c(=O)oc31,CCO,451.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(/C=C/C=C(/C#N)C(=O)O)c(=O)oc31,CCO,506.0
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(/C=C/C=C/C=C(/C#N)C(=O)O)c(=O)oc31,CCO,509.5
CC1(C)CCN2CCC(C)(C)c3c2c1cc1cc(/C=C/c2ccc(/C=C(\C#N)C(=O)O)s2)c(=O)oc31,CCO,509.4
CC1(C)CCN2CCC(C)(C)c3c4c(cc1c32)C(c1ccccc1C(=O)[O-])=c1cc2c3c(c1O4)C(C)(C)CC[N+]=3CCC2(C)C,CS(C)=O,577.0
CC1(C)CC[N+]2=c3c(cc4c(c31)Oc1cc3c(cc1C=4c1ccccc1C(=O)O)C(c1ccccc1C(=O)O)=c1cc4c5c(c1O3)C(C)(C)CC[N+]=5CCC4)CCC2,ClC(Cl)Cl,611.0
CC1(C)CCc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)CC2)O1,C1CCCCC1,431.0344828
CC1(C)CCc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)CC2)O1,C1COCCO1,434.9717268
CC1(C)CCc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)CC2)O1,CC#N,434.9717268
CC1(C)CCc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)CC2)O1,CC(C)O,431.9654428
CC1(C)CCc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)CC2)O1,CCCCCC,429.9226139
CC1(C)CCc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)CC2)O1,ClC(Cl)Cl,437.0629371
CC1(C)CCc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)CC2)O1,c1ccccc1,434.9717268
CC1(C)CCc2c(c3ccccc3c3nc4ccccc4nc23)O1,C1CCCCC1,429.9226139
CC1(C)CCc2c(c3ccccc3c3nc4ccccc4nc23)O1,C1CCOC1,434.0277778
CC1(C)CCc2c(c3ccccc3c3nc4ccccc4nc23)O1,CN(C)C=O,438.9815628
CC1(C)CCc2c(c3ccccc3c3nc4ccccc4nc23)O1,CO,434.9717268
CC1(C)CCc2c(c3ccccc3c3nc4ccccc4nc23)O1,ClC(Cl)Cl,437.0629371
CC1(C)CCc2c(c3ccccc3c3nc4ccccc4nc23)O1,c1ccccc1,431.0344828
CC1(C)COc2c(/C=C(\C#N)C(=O)O)sc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCC(C)(C)CO4)c2OC1,C1CCOC1,499.0
CC1(C)Cc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)C2)O1,C1CCCCC1,451.059991
CC1(C)Cc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)C2)O1,C1COCCO1,453.9264639
CC1(C)Cc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)C2)O1,CC#N,454.9590537
CC1(C)Cc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)C2)O1,CC(C)O,452.079566
CC1(C)Cc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)C2)O1,CCCCCC,450.0450045
CC1(C)Cc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)C2)O1,ClC(Cl)Cl,457.0383912
CC1(C)Cc2c(c3ccccc3c3nc4c(nc23)c2c(c3ccccc34)OC(C)(C)C2)O1,c1ccccc1,454.9590537
CC1(C)Cc2c(c3ccccc3c3nc4c5c(c6ccccc6c4nc23)OC(C)(C)C5)O1,C1CCCCC1,484.9660524
CC1(C)Cc2c(c3ccccc3c3nc4c5c(c6ccccc6c4nc23)OC(C)(C)C5)O1,C1COCCO1,488.997555
CC1(C)Cc2c(c3ccccc3c3nc4c5c(c6ccccc6c4nc23)OC(C)(C)C5)O1,CC#N,488.997555
CC1(C)Cc2c(c3ccccc3c3nc4c5c(c6ccccc6c4nc23)OC(C)(C)C5)O1,CC(C)O,485.9086492
CC1(C)Cc2c(c3ccccc3c3nc4c5c(c6ccccc6c4nc23)OC(C)(C)C5)O1,CCCCCC,483.0917874
CC1(C)Cc2c(c3ccccc3c3nc4c5c(c6ccccc6c4nc23)OC(C)(C)C5)O1,ClC(Cl)Cl,490.9180167
CC1(C)Cc2c(c3ccccc3c3nc4c5c(c6ccccc6c4nc23)OC(C)(C)C5)O1,c1ccccc1,488.0429478
CC1(C)Cc2c(c3ccccc3c3nc4ccccc4nc23)O1,C1CCCCC1,455.996352
CC1(C)Cc2c(c3ccccc3c3nc4ccccc4nc23)O1,C1CCOC1,459.9816007
CC1(C)Cc2c(c3ccccc3c3nc4ccccc4nc23)O1,CN(C)C=O,457.0383912
CC1(C)Cc2c(c3ccccc3c3nc4ccccc4nc23)O1,CO,458.0852038
CC1(C)Cc2c(c3ccccc3c3nc4ccccc4nc23)O1,ClC(Cl)Cl,459.9816007
CC1(C)Cc2c(c3ccccc3c3nc4ccccc4nc23)O1,c1ccccc1,458.0852038
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,C1CCOC1,407.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CC#N,421.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CCCCO,424.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CCCO,423.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CCO,424.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CCOC(C)=O,403.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CN(C)C=O,421.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CO,424.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,CS(C)=O,424.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,Cc1ccccc1,404.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,ClC(Cl)(Cl)Cl,395.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,ClCCl,403.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,O,404.0
CC1(C)Nc2cc(Cl)ccc2-c2[nH]c3ccccc3c(=O)c21,c1ccccc1,404.0
CC1(C)Nc2cc3nc4cc(Br)c(Br)cc4nc3cc2N1,CCO,473.0
CC1(C)Nc2cc3nc4cc(Cl)c(Cl)cc4nc3cc2N1,CCO,471.0
CC1(C)Nc2cc3nc4cc(F)c(F)cc4nc3cc2N1,CCO,440.0
CC1(C)OB(c2cc3ccc4cc(B5OC(C)(C)C(C)(C)O5)cc5ccc(c2)c3c45)OC1(C)C,Cc1ccccc1,398.0
CC1(C)OB(c2ccc3c(c2)B2Nc4ccccc4C=C2C(c2ccccc2)=C3c2ccccc2)OC1(C)C,ClCCl,390.0
CC1(C)OB(c2ccc3ccc4cccc5ccc2c3c45)OC1(C)C,Cc1ccccc1,378.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,C1CCCCC1,504.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,C1CCOC1,486.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,CC(C)=O,479.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,CS(C)=O,487.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,Cc1ccccc1,504.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,ClC(Cl)Cl,523.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,ClCCl,509.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,534.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,538.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,544.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,572.0
CC1(C)OC(=C(C#N)C#N)C(C#N)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,565.0
CC1(C)OC(=C(C#N)C#N)C(S(=O)(=O)c2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,520.0
CC1(C)OC(=C(C#N)C#N)C(S(=O)(=O)c2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,541.0
CC1(C)OC(=C(C#N)C#N)C(S(=O)(=O)c2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC(C)=O,545.0
CC1(C)OC(=C(C#N)C#N)C(S(=O)(=O)c2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,CS(C)=O,566.0
CC1(C)OC(=C(C#N)C#N)C(S(=O)(=O)c2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,541.0
CC1(C)OC(=C(C#N)C#N)C(S(=O)(=O)c2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,566.0
CC1(C)OC(=C(C#N)C#N)C(S(=O)(=O)c2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,563.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,C1CCCCC1,461.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,C1CCOC1,447.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,CC(C)=O,448.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,CS(C)=O,455.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,Cc1ccccc1,462.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,ClC(Cl)Cl,463.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,ClCCl,457.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,486.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,491.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC(C)=O,497.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,CS(C)=O,511.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,486.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,503.0
CC1(C)OC(=C(C#N)C#N)C(Sc2ccccc2)=C1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,503.0
CC1(C)OC(=O)C(=CC=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)C(=O)O1,ClCCl,498.0
CC1(C)OC(=O)C(=CC=CC=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)C(=O)O1,ClCCl,576.0
CC1(C)c2cc(-c3c4ccccc4c(-c4c5ccccc5c(-c5ccc6c(c5)C(C)(C)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5-6)c5ccccc45)c4ccccc34)ccc2-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc21,ClCCl,463.0
CC1(C)c2cc(-c3c4ccccc4c(-c4ccc(-c5c6ccccc6c(-c6ccccc6)c6ccccc56)cc4)c4ccccc34)ccc2-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc21,ClCCl,439.0
CC1(C)c2cc(-c3c4ccccc4c(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)c4ccccc34)ccc2-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc21,ClCCl,453.0
CC1(C)c2cc(-c3ccc(O)c(O)c3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,362.0
CC1(C)c2cc(-c3ccc4ccccc4c3)cc(-c3ccc4ccccc4c3)c2N2CC(=O)NC21C,C1CCOC1,299.0
CC1(C)c2cc(-c3cccc4c3sc3ccccc34)ccc2N2CC(=O)NC21C,C1CCOC1,333.0
CC1(C)c2cc(-c3ccccc3)cc(-c3ccccc3)c2N2CC(=O)NC21C,C1CCOC1,287.0
CC1(C)c2cc(-c3ccccc3)ccc2N2CC(=O)NC21C,C1CCOC1,345.0
CC1(C)c2cc(-c3ccccc3)ccc2N2CCC(=O)NC21C,C1CCOC1,290.0
CC1(C)c2cc(-c3ccncc3)cc3c2N2c4c1cc(-c1ccncc1)cc4C(C)(C)c1cc(-c4ccncc4)cc(c12)C3(C)C,ClCCl,373.0
CC1(C)c2cc(-n3c4ccccc4c4ccccc43)ccc2N(c2ccc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc21,Cc1ccccc1,373.3791749
CC1(C)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc21,C1CCOC1,505.0
CC1(C)c2cc(/C=C/c3nc(/C=C/c4ccc5c(c4)C(C)(C)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(/C=C/c4ccc5c(c4)C(C)(C)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,429.0
CC1(C)c2cc(C#N)ccc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc21,C1CCCCC1,395.0
CC1(C)c2cc(C#N)ccc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc21,C1CCOC1,380.0
CC1(C)c2cc(C#N)ccc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc21,CC#N,375.0
CC1(C)c2cc(C#N)ccc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc21,Cc1ccccc1,390.0
CC1(C)c2cc(C#N)ccc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc21,ClC(Cl)Cl,389.0
CC1(C)c2cc(C=C(C#N)C(=O)O)ccc2-c2ccc(-c3ccc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)cc21,C1CCOC1,436.0
CC1(C)c2cc(C=C(C#N)C(=O)O)ccc2-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc21,C1CCOC1,427.0
CC1(C)c2cc(C=C(C#N)C(=O)O)ccc2-c2ccc(-c3ccc(-c4sc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)c5c4OCCO5)s3)cc21,C1CCOC1,454.0
CC1(C)c2cc(C=C(C#N)C(=O)O)ccc2-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,C1CCOC1,402.0
CC1(C)c2cc(C=C(C#N)C(=O)O)ccc2-c2ccc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCCO4)cc21,C1CCOC1,443.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCC3)cc21,C1COCCO1,375.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCC3)cc21,CC#N,377.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCC3)cc21,CCO,380.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCC3)cc21,CS(C)=O,386.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCC3)cc21,Cc1ccccc1,378.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCC3)cc21,ClC(Cl)Cl,384.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCC3)cc21,O,377.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCC3)cc21,C1COCCO1,391.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCC3)cc21,CC#N,391.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCC3)cc21,CCO,395.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCC3)cc21,CS(C)=O,400.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCC3)cc21,Cc1ccccc1,394.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCC3)cc21,ClC(Cl)Cl,396.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCC3)cc21,O,407.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCC3)cc21,C1COCCO1,375.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCC3)cc21,CC#N,376.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCC3)cc21,CCO,373.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCC3)cc21,CS(C)=O,385.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCC3)cc21,Cc1ccccc1,371.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCC3)cc21,ClC(Cl)Cl,380.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCC3)cc21,O,376.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCCC3)cc21,C1COCCO1,394.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCCC3)cc21,CC#N,397.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCCC3)cc21,CCO,398.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCCC3)cc21,CS(C)=O,405.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCCC3)cc21,Cc1ccccc1,397.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCCC3)cc21,ClC(Cl)Cl,402.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCCCCC3)cc21,O,411.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCOCC3)cc21,C1COCCO1,365.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCOCC3)cc21,CC#N,365.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCOCC3)cc21,CCO,365.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCOCC3)cc21,CS(C)=O,375.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCOCC3)cc21,Cc1ccccc1,365.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCOCC3)cc21,ClC(Cl)Cl,368.0
CC1(C)c2cc(C=O)ccc2-c2ccc(N3CCOCC3)cc21,O,353.0
CC1(C)c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2Oc2c(-n3c4ccccc4c4ccccc43)cccc21,Cc1ccccc1,341.0
CC1(C)c2cccc3c2N2c4c1cc(-c1ccncc1)cc4C(C)(C)c1cc(-c4ccncc4)cc(c12)C3(C)C,ClCCl,376.0
CC1(C)c2cccc3c2N2c4c1cccc4C(C)(C)c1cc(-c4ccncc4)cc(c12)C3(C)C,ClCCl,364.0
CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)cc3)c3ccc4c(c3)-c3ccccc3C4(C)C)ccc21,CCO,452.0
CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21,C1CCOC1,402.0
CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3)c3ccc4c(c3)-c3ccccc3C4(C)C)ccc21,CCO,436.0
CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc(/C=C\C=C(C#N)C(=O)O)s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21,CCO,438.0
CC1(C)c2ccccc2-c2cc(N(c3ccc(-c4ccc(N(c5ccc(-c6ccc(N(c7ccc8c(c7)C(C)(C)c7ccccc7-8)c7ccc8c(c7)C(C)(C)c7ccccc7-8)cc6)cc5)c5ccc(-c6sc(C=C(C#N)C(=O)O)c7c6OCCO7)cc5)cc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc21,ClCCl,479.0
CC1(C)c2ccccc2-c2cc3c(C#C[Si](C)(C)C)c4ccccc4c(C#C[Si](C)(C)C)c3cc21,ClCCl,455.0
CC1(C)c2ccccc2-c2cc3c(C#Cc4ccc(C(F)(F)F)cc4)c4ccccc4c(C#Cc4ccc(C(F)(F)F)cc4)c3cc21,ClCCl,483.0
CC1(C)c2ccccc2-c2cc3c(C#Cc4ccccc4)c4ccccc4c(C#Cc4ccccc4)c3cc21,ClCCl,478.0
CC1(C)c2ccccc2-c2cc3c(cc21)N(c1ccc(-c2nc(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6cc7c(cc65)C(C)(C)c5ccccc5-7)cc4)nc(-c4ccc(N5c6ccccc6C(c6ccccc6)(c6ccccc6)c6cc7c(cc65)C(C)(C)c5ccccc5-7)cc4)n2)cc1)c1ccccc1C3(c1ccccc1)c1ccccc1,Cc1ccccc1,321.0
CC1(C)c2ccccc2-c2cc3c4cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc4n(-c4ccccc4)c3cc21,CN(C)C=O,424.0
CC1(C)c2ccccc2-c2cc3c4cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc4n(-c4ccccc4)c3cc21,CN(C)C=O,412.0
CC1(C)c2ccccc2-c2cc3c4cc(-n5c6ccccc6c6ccccc65)ccc4n(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)c3cc21,ClCCl,350.0
CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)c3cc21,CN(C)C=O,426.0
CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)c3cc21,CN(C)C=O,393.0
CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)cc4)c3cc21,Cc1ccccc1,362.0
CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(/C=C/c5ccc(/C=C(/C#N)C(=O)O)s5)cc4)c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)cc3)cc21,CCO,461.0
CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)Sc3cc(-c5ccc(C#Cc6cc(-c7cccc(C(=O)O)c7)cc(-c7cccc(C(=O)O)c7)c6)s5)ccc3N4c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,CN(C)C=O,415.0
CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)Sc3cc(-c5ccc(C#Cc6cc(-c7cccnc7)cc(-c7cccnc7)c6)s5)ccc3N4c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,CN(C)C=O,412.0
CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)Sc3cc(-c5ccc(C#Cc6ccc(C(=O)O)cc6)s5)ccc3N4c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,CN(C)C=O,418.0
CC1(C)c2ccccc2-c2ccc(-n3c(-c4ccccc4)c(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)c4ccccc43)cc21,CCO,433.0
CC1(C)c2ccccc2-c2ccc(-n3c(-c4ccccc4)cc4cc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)ccc43)cc21,CCO,429.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc43)cc21,CCO,435.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6ccc(/C=C7\SC(=S)N(CC(=O)O)C7=O)s6)s5)ccc43)cc21,CCO,489.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)ccc43)cc21,CCO,435.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6ccc(C=C7SC(=S)N(CC(=O)O)C7=O)s6)s5)ccc43)cc21,CCO,489.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(/C=C(/C#N)C(=O)O)s5)ccc43)cc21,CCO,411.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(/C=C/c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc43)cc21,CCO,451.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(/C=C6\SC(=S)N(CC(=O)O)C6=O)s5)ccc43)cc21,CCO,469.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(C=C(C#N)C(=O)O)s5)ccc43)cc21,CCO,411.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(C=C6SC(=S)N(CC(=O)O)C6=O)s5)ccc43)cc21,CCO,469.0
CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(C=Cc6ccc(C=C(C#N)C(=O)O)s6)s5)ccc43)cc21,CCO,451.0
CC1(C)c2ccccc2-c2ccc(C#Cc3c4ccccc4c(C#Cc4ccc5c(c4)C(C)(C)c4ccccc4-5)c4cc5c(cc34)-c3ccc(Br)cc3C5(C)C)cc21,ClCCl,501.0
CC1(C)c2ccccc2-c2ccc(C#Cc3c4ccccc4c(C#Cc4ccc5c(c4)C(C)(C)c4ccccc4-5)c4cc5c(cc34)-c3ccccc3C5(C)C)cc21,ClCCl,500.0
CC1(C)c2ccccc2-c2ccc(C3c4cc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)cc5c4C(CCC5)N3c3ccccc3)cc21,CCO,445.0
CC1(C)c2ccccc2-c2ccc(C3c4ccc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)c5c4C(CCC5)N3c3ccccc3)cc21,CCO,425.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(C=C(C#N)C(=O)O)cc4[Si]5(C)C)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,504.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(C=C(C#N)C(=O)O)cc4[Si]5(C)c4ccccc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,485.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(C=C(C#N)C(=O)O)cc4[Si]5(c4ccccc4)c4ccccc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,459.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5sc(-c6cc(F)c(C=C(C#N)C(=O)O)c(F)c6)cc5s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,428.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5sc(-c6ccc(C=C(C#N)C(=O)O)cc6)cc5s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,415.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5sc(-c6sc(/C=C(\C#N)C(=O)O)c7c6OCCO7)cc5s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,ClC(Cl)Cl,469.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5sc(/C=C(\C#N)C(=O)O)cc5s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,ClC(Cl)Cl,514.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cc5sc6cc(C(C#N)C(=O)O)sc6c5s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,ClC(Cl)Cl,525.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5c(F)c(F)c(-c6ccc(/C=C(\C#N)C(=O)O)s6)c6nsnc56)s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,461.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5c(F)cc(-c6ccc(/C=C(\C#N)C(=O)O)s6)c6nsnc56)s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,538.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)c6nsnc56)s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,535.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)c6nsnc56)s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,CCO,534.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,C1CCOC1,452.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc5ccccc5c5c4oc4ccccc45)cc3)cc21,C1CCOC1,359.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)o5)c5nsnc45)cc3)cc21,C1CCOC1,401.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)o5)cc4)cc3)cc21,C1CCOC1,418.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)cc3)cc21,C1CCOC1,402.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)cc21,C1CCOC1,461.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cnc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,ClCCl,575.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4sc(-c5sc(C=C(C#N)C(=O)O)c6c5OCCO6)c5c4OCCO5)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,ClC(Cl)Cl,544.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4sc(C=C(C#N)C(=O)O)c5c4C4C=CC5CC4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,ClCCl,485.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4sc(C=C(C#N)C(=O)O)c5ccccc45)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,ClCCl,569.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(C=C(C#N)C(=O)O)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,Clc1ccccc1,454.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc(N=Nc4ccc(C#N)cc4)cc3)c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21,Cc1ccccc1,508.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)sc3-4)cc21,CCO,480.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5ccc(C=C(C#N)C(=O)O)s5)ccc3-4)cc21,CCO,428.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(C=C(C#N)C(=O)O)ccc3-4)cc21,CCO,427.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)sc4c3)cc21,CCO,456.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4cc(/C=C/c5ccc(/C=C(/C#N)C(=O)O)s5)oc4c3)cc21,CCO,479.0
CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4cc(/C=C/c5ccc(/C=C(/C#N)C(=O)O)s5)sc4c3)cc21,CCO,476.0
CC1(C)c2ccccc2-c2ccc(N3c4ccc(-c5ccc(/C=C6\C(=O)c7ccc(C(=O)O)cc7C6=O)s5)cc4C4CCCC43)cc21,ClC(Cl)Cl,608.0
CC1(C)c2ccccc2-c2ccc(N3c4ccc(-c5ccc(C=C6C(=O)c7ccc(C(=O)O)cc7C6=O)s5)cc4C4CCCC43)cc21,ClC(Cl)Cl,610.0
CC1(C)c2ccccc2-c2ccc([C@@H]3c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)c5c4[C@@H](CCC5)N3c3ccccc3)cc21,CCO,425.0
CC1(C)c2ccccc2-c2ccc([C@H]3c4cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc5c4[C@H](CCC5)N3c3ccccc3)cc21,CCO,445.0
CC1(C)c2ccccc2-c2sc3ccccc3c21,ClCCl,330.0
CC1(C)c2ccccc2C(C)(C)c2ccccc21,CCCCCC,256.0
CC1(C)c2ccccc2N(c2c(F)cc(-c3nnc(-c4ccccc4)o3)cc2F)c2ccccc21,Cc1ccccc1,376.0
CC1(C)c2ccccc2N(c2c(F)cc(-c3nnc(-c4ccccc4)o3)cc2F)c2ccccc21,O=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccccc1P(=O)(c1ccccc1)c1ccccc1,370.0
CC1(C)c2ccccc2N(c2cc(C#N)c(C#N)cc2N2c3ccccc3C(C)(C)c3ccccc32)c2ccccc21,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,494.0
CC1(C)c2ccccc2N(c2cc3c4ccccc4n4c5ccccc5c(c2)c34)c2ccccc21,C1CCOC1,368.0
CC1(C)c2ccccc2N(c2ccc(-c3cc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)c2ccccc21,Cc1ccccc1,374.9508841
CC1(C)c2ccccc2N(c2ccc(-c3cc(C#N)c(C#N)cc3-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,384.0
CC1(C)c2ccccc2N(c2ccc(-c3ccc(C#N)cc3)cc2)c2ccccc21,Cc1ccccc1,358.0
CC1(C)c2ccccc2N(c2ccc(-c3ccc(C#N)cn3)cc2)c2ccccc21,Cc1ccccc1,384.0
CC1(C)c2ccccc2N(c2ccc(-c3ccc(C#N)nc3)cc2)c2ccccc21,Cc1ccccc1,369.0
CC1(C)c2ccccc2N(c2ccc(-c3ccc4c(c3)C(=O)c3ccc(-c5ccc(N6c7ccccc7C(C)(C)c7ccccc76)cc5)cc3C4=O)cc2)c2ccccc21,Cc1ccccc1,446.0
CC1(C)c2ccccc2N(c2ccc(-c3ccc4c(c3)c3cc(-c5ccc(N6c7ccccc7C(C)(C)c7ccccc76)cc5)ccc3c3nc(C#N)c(C#N)nc43)cc2)c2ccccc21,Cc1ccccc1,405.0
CC1(C)c2ccccc2N(c2ccc(-c3cccc(C#N)c3)cc2)c2ccccc21,Cc1ccccc1,344.0
CC1(C)c2ccccc2N(c2ccc(-c3cnc(C#N)nc3)cc2)c2ccccc21,Cc1ccccc1,384.0
CC1(C)c2ccccc2N(c2ccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)cc2)c2ccccc21,Cc1ccccc1,366.6011788
CC1(C)c2ccccc2N(c2ccc(-c3nc(-c4ccccn4)n(-c4ccccc4)n3)cc2)c2ccccc21,ClCCl,342.0
CC1(C)c2ccccc2N(c2ccc(-c3nc(C#N)c(C#N)nc3-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,436.0
CC1(C)c2ccccc2N(c2ccc(-c3nc([C@]45CC6CC(C[C@@H](C6)C4)C5)nc([C@]45C[C@@H]6C[C@H](C[C@H](C6)C4)C5)n3)cc2)c2ccccc21,Cc1ccccc1,367.8010471
CC1(C)c2ccccc2N(c2ccc(-c3nc4cc(C#N)c(C#N)cc4nc3-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,454.0
CC1(C)c2ccccc2N(c2ccc(-c3nc4ccccc4nc3-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,400.0
CC1(C)c2ccccc2N(c2ccc(-c3nc4cccnc4nc3-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,409.0
CC1(C)c2ccccc2N(c2ccc(-c3nc4ccncc4nc3-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,414.0
CC1(C)c2ccccc2N(c2ccc(-c3ncccn3)cc2)c2ccccc21,Cc1ccccc1,359.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccc(N5c6ccccc6C(C)(C)c6ccccc65)cc4)o3)cc2)c2ccccc21,Cc1ccccc1,360.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,C1CCOC1,361.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,C1COCCO1,363.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,CC#N,358.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,CC(C)=O,361.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,CCCCCC,362.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,CCO,361.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,CCOC(C)=O,360.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,CN(C)C=O,360.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,CS(C)=O,364.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,Cc1ccccc1,362.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,ClC(Cl)Cl,365.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,ClCCCl,368.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,ClCCl,366.0
CC1(C)c2ccccc2N(c2ccc(-c3nnc(-c4ccccc4O)o3)cc2)c2ccccc21,Clc1ccccc1,367.0
CC1(C)c2ccccc2N(c2ccc(C(=C(C#N)C#N)c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,436.0
CC1(C)c2ccccc2N(c2ccc(C(=CC#N)c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,373.0
CC1(C)c2ccccc2N(c2ccc(C(=O)/C=C(\O)c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc2)c2ccccc21,Cc1ccccc1,406.0
CC1(C)c2ccccc2N(c2ccc3c(c2)-c2cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc2P3(=O)c2ccccc2)c2ccccc21,Cc1ccccc1,389.0
CC1(C)c2ccccc2N(c2ccc3c(c2)C(=O)c2ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc2C3=O)c2ccccc21,Cc1ccccc1,527.0
CC1(C)c2ccccc2N(c2ccc3c(c2)C(C)(C)c2cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc2S3(=O)=O)c2ccccc21,Cc1ccccc1,361.4035088
CC1(C)c2ccccc2N(c2ccc3c(c2)C(C)(C)c2cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc2S3(=O)=O)c2ccccc21,ClCCl,365.0
CC1(C)c2ccccc2N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc2S3(=O)=O)c2ccccc21,Cc1ccccc1,364.0
CC1(C)c2ccccc2N(c2ccc3c(c2)C2(c4cc(N5c6ccccc6C(C)(C)c6ccccc65)ccc4-3)c3ccccc3S(=O)(=O)c3ccccc32)c2ccccc21,Cc1ccccc1,364.0
CC1(C)c2ccccc2N(c2ccc3c(c2)Oc2ccccc2P3(=O)c2ccccc2)c2ccccc21,Cc1ccccc1,348.0
CC1(C)c2ccccc2N(c2ccc3c(c2)Oc2ccccc2S3(=O)=O)c2ccccc21,Cc1ccccc1,356.0
CC1(C)c2ccccc2N(c2ccc3c(c2)S(=O)(=O)c2cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc2C3(C)C)c2ccccc21,ClCCl,282.0
CC1(C)c2ccccc2N(c2ccc3c(c2)c(=O)c2cccc4c(=O)c5cc(N6c7ccccc7C(C)(C)c7ccccc76)ccc5n3c24)c2ccccc21,Cc1ccccc1,432.9648895
CC1(C)c2ccccc2N(c2ccc3c(c2)c2cc(N4c5ccccc5C(C)(C)c5ccccc54)cc4c5ccccc5n3c42)c2ccccc21,C1CCOC1,367.0
CC1(C)c2ccccc2N(c2ccc3c(c2)c2cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc2c2nc(C#N)c(C#N)nc32)c2ccccc21,Cc1ccccc1,464.0
CC1(C)c2ccccc2N(c2ccc3c(c2)c2cc(N4c5ccccc5C(C)(C)c5ccccc54)ccc2c2nc4ccccc4nc32)c2ccccc21,Cc1ccccc1,380.0
CC1(C)c2ccccc2N(c2ccc3c(c2)c2ccccc2n2c4ccccc4nc32)c2ccccc21,Cc1ccccc1,376.0
CC1(C)c2ccccc2N(c2ccc3c(ccc4nc5ccc6cc(N7c8ccccc8C(C)(C)c8ccccc87)ccc6c5nc43)c2)c2ccccc21,C1CCCCC1,413.0
CC1(C)c2ccccc2N(c2ccc3c(ccc4nc5ccc6cc(N7c8ccccc8C(C)(C)c8ccccc87)ccc6c5nc43)c2)c2ccccc21,C1CCOC1,416.0
CC1(C)c2ccccc2N(c2ccc3c(ccc4nc5ccc6cc(N7c8ccccc8C(C)(C)c8ccccc87)ccc6c5nc43)c2)c2ccccc21,CN(C)C=O,418.0
CC1(C)c2ccccc2N(c2ccc3c(ccc4nc5ccc6cc(N7c8ccccc8C(C)(C)c8ccccc87)ccc6c5nc43)c2)c2ccccc21,Cc1ccccc1,416.0
CC1(C)c2ccccc2N(c2ccc3c(ccc4nc5ccc6cc(N7c8ccccc8C(C)(C)c8ccccc87)ccc6c5nc43)c2)c2ccccc21,ClCCl,416.0
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4N5c4ccccc4)c4nsnc34)cc21,Cc1ccccc1,475.4180602
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)n4-c4ccccc4)cc3)cc21,C1CCOC1,349.0
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5n4-c4ccccc4)cc3)cc21,C1CCOC1,367.0
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,C1CCOC1,466.0
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(C(=O)c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5N6c5ccccc5)cc4)cc3)cc21,Cc1ccccc1,377.5919732
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3ccc(S(=O)(=O)c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5N6c5ccccc5)cc4)cc3)cc21,Cc1ccccc1,363.3779264
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3cccc(-c4nc5c6ccccc6c6ccccc6c5n4-c4ccccc4)c3)cc21,C1CCOC1,324.0
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21,Cc1ccccc1,389.9665552
CC1(C)c2ccccc2N(c2ccccc2)c2ccc(S(=O)(=O)c3ccc4c(c3)C(C)(C)c3ccccc3N4c3ccccc3)cc21,Cc1ccccc1,340.6354515
CC1(C)c2ccccc2N2CC(=O)NC21C,C1CCOC1,240.0
CC1(C)c2ccccc2N2c3ccccc3C3(c4cc(C#N)ccc4-c4ccc(C#N)cc43)c3cccc1c32,Cc1ccccc1,327.7777778
CC1(CCCC(=O)O)/C(=C/C=C/C=C/c2cc(-c3ccccc3)[o+]c3cc4c(cc23)C(CS(=O)(=O)[O-])=CC(C)(C)N4CCCS(=O)(=O)[O-])N(CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)[O-])cc21,CCO,767.0
CC1(CCCC(=O)O)/C(=C/C=C/c2cc(-c3ccccc3)[o+]c3cc4c(cc23)C(CS(=O)(=O)[O-])=CC(C)(C)N4CCCS(=O)(=O)[O-])N(CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)[O-])cc21,CCO,674.0
CC1(CCCCC(=O)NCCCCCCO)C(/C=C/C=C/C=C2/N(CCCS(=O)(=O)[O-])c3ccc(S(=O)(=O)[O-])cc3C2(C)C)=[N+](CCCS(=O)(=O)[O-])c2ccc(S(=O)(=O)[O-])cc21,O,651.0
CC1=C(/C=C/c2ccccc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(/C=C/c3ccccc3)c(C)n1[B-]2(F)F,ClC(Cl)Cl,575.0
CC1=C(/C=C/c2ccccc2)C2=Cc3c(/C=C/c4ccccc4)c(C)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,572.0
CC1=C(Br)C(/C=C/c2ccncc2)=[N+]2C1=C(c1ccccc1)c1c(C)c(Br)c(/C=C/c3ccncc3)n1[B-]2(F)F,ClC(Cl)Cl,620.0
CC1=C(Br)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)c(Br)c(C)n1[B-]2(F)F,ClCCl,548.0
CC1=C(C#Cc2ccc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)cc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(C#Cc3ccc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)cc3)c(C)n1[B-]2(F)F,ClCCl,576.0
CC1=C(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C)n1[B-]2(F)F,C1CCOC1,593.0
CC1=C(C#Cc2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(C#Cc3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)c(C)n1[B-]2(F)F,ClCCl,575.0
CC1=C(C#Cc2ccccc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(C#Cc3ccccc3)c(C)n1[B-]2(F)F,C1CCOC1,573.0
CC1=C(C#Cc2ccccc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(C#Cc3ccccc3)c(C)n1[B-]2(F)F,ClCCl,561.0
CC1=C(C)SC(=Cc2sc(C=C(C#N)C(=O)O)cc2CO[Si](C)(C)C(C)(C)C)S1,ClCCl,568.0
CC1=C(C)c2cccc3c2c(cc2nc4ccccc4nc23)O1,ClCCl,497.0
CC1=C(C2=C(C)C(C)=[N+]3C2=Cc2cc(C)c(C)n2[B-]3(F)F)C2=Cc3cc(C)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,557.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,C1CCOC1,525.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,C1COCCO1,524.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,CC#N,517.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,CC(C)O,518.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,CCO,516.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,CCOC(C)=O,523.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,CN(C)C=O,526.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,CO,514.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,CS(C)=O,522.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,Cc1ccccc1,527.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,ClC(Cl)Cl,523.0
CC1=C(Cc2ccccc2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3csc(N4CCOCC4)n3)c(C)n1[B-]2(F)F,ClCCl,522.0
CC1=C(Cl)C(/C=C/c2ccc3c(c2)c2ccccc2n3Cc2cn(CCC[P+](c3ccccc3)(c3ccccc3)c3ccccc3)nn2)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)c(Cl)c(C)n1[B-]2(F)F,CCO,612.0
CC1=C(I)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)c(I)c(C)n1[B-]2(F)F,ClCCl,554.0
CC1=C(I)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,534.0
CC1=C([Fe]C2=C(C)c3ccccc3C2C)C(C)c2ccccc21,ClCCl,422.0
CC1=C(c2ccc(C=C(C#N)C(=O)O)s2)C(C)=[N+]2C1=C(C)c1c(C)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C)n1[B-]2(F)F,ClC(Cl)Cl,537.0
CC1=C(c2ccc(CN[C@@H]3C[C@H]3NCc3ccc(C4=CCC4C)s3)s2)CC1,CCO,310.0
CC1=C(c2ccc(N(C)C)cc2)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)c(-c3ccc(N(C)C)cc3)c(C)n1[B-]2(F)F,ClCCl,574.0
CC1=C(c2ccc(N(C)C)cc2)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,538.0
CC1=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,537.0
CC1=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)C(C)=[N+]2C1C(C)c1c(C)c(/C=C(\C#N)C(=O)O)c(C)n1[B-]2(F)F,ClC(Cl)Cl,534.0
CC1=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)C(C)=[N+]2C1C(c1ccccc1)c1c(C)c(C=C(C#N)C(=O)O)c(C)n1[B-]2(F)F,ClC(Cl)Cl,537.0
CC1=C(c2ccccc2)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)c(-c3ccccc3)c(C)n1[B-]2(F)F,ClCCl,548.0
CC1=C(c2ccccc2)C(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,532.0
CC1=C(c2ccccc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3ccccc3)c(C)n1[B-]2(F)F,CO,524.0
CC1=C(c2ccccc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3ccccc3)c(C)n1[B-]2(F)F,Cc1ccccc1,530.0
CC1=C(c2ccccc2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3ccccc3)c(C)n1[B-]2(F)F,ClCCl,528.0
CC1=C(c2ccccc2)c2cc3c(C)cc(C)n3c(=O)n2C1=O,C1CCCCC1,437.0
CC1=C(c2cccs2)C(C)=[N+]2C1=C(c1ccc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])cc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,CO,526.0
CC1=C(c2cccs2)C(C)=[N+]2C1=C(c1ccc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])cc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,Cc1ccccc1,535.0
CC1=C(c2cccs2)C(C)=[N+]2C1=C(c1ccc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])cc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,ClCCl,533.0
CC1=C(c2cccs2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,CO,521.0
CC1=C(c2cccs2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,Cc1ccccc1,530.0
CC1=C(c2cccs2)C(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,ClCCl,527.0
CC1=C2C3=C(CCc4ccccc43)C(C)=[N+]2[B-](F)(F)n2c(C)c3c(c21)-c1ccccc1CC3,CC#N,559.0
CC1=C2C=CC(=[N+](C)C)C=C2C(C)(C)c2cc(N(C)C)ccc21,CCO,602.0
CC1=C2C=CC(C)=[N+]2[B-](F)(F)n2cccc21,CCCCCC,499.0
CC1=C2C=CC(C)=[N+]2[B-](F)(F)n2cccc21,CO,494.0
CC1=C2C=CC(C)=[N+]2[B-](F)(F)n2cccc21,ClCCl,498.0
CC1=C2C=CC(c3ccccc3)=[N+]2[B-](F)(F)n2c1ccc2-c1ccccc1,ClCCl,544.0
CC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCCCCC,500.0
CC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CO,494.0
CC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,ClCCl,499.0
CC1=C2CCc3ccccc3C2=[N+]2C1=C(c1ccc(I)cc1)c1c(C)c3c(n1[B-]2(F)F)-c1ccccc1CC3,ClC(Cl)Cl,619.0
CC1=C2c3ccccc3C(C)=[N+]2[B-](F)(F)n2c(C)c3cc4c(-c5ccccc5)c5c(c(-c6ccccc6)c4cc3c21)-c1cccc2cccc-5c12,ClCCl,681.0
CC1=C2c3ccccc3C(c3[nH]c(C)cc3C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,C1CCOC1,599.0
CC1=C2c3ccccc3C(c3[nH]c(C)cc3C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC#N,590.0
CC1=C2c3ccccc3C(c3[nH]c(C)cc3C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CCCCCC,601.0
CC1=C2c3ccccc3C(c3[nH]c(C)cc3C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CO,593.0
CC1=C2c3ccccc3C(c3[nH]c(C)cc3C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,Cc1ccccc1,605.0
CC1=C2c3ccccc3C(c3[nH]c(C)cc3C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,ClCCl,599.0
CC1=C2c3ccccc3C(c3ccc[nH]3)=[N+]2[B-](F)(F)n2cccc21,C1CCOC1,564.0
CC1=C2c3ccccc3C(c3ccc[nH]3)=[N+]2[B-](F)(F)n2cccc21,CC#N,555.0
CC1=C2c3ccccc3C(c3ccc[nH]3)=[N+]2[B-](F)(F)n2cccc21,CCCCCC,566.0
CC1=C2c3ccccc3C(c3ccc[nH]3)=[N+]2[B-](F)(F)n2cccc21,CO,558.0
CC1=C2c3ccccc3C(c3ccc[nH]3)=[N+]2[B-](F)(F)n2cccc21,Cc1ccccc1,570.0
CC1=C2c3ccccc3C(c3ccc[nH]3)=[N+]2[B-](F)(F)n2cccc21,ClCCl,563.0
CC1=CB(O)N2B(c3ccccc3)C=C(C)c3cccc1c32,ClCCl,353.0
CC1=CB(c2ccccc2)N2B(c3ccc(C)cc3)C=C(C)c3cccc1c32,ClCCl,387.0
CC1=CB(c2ccccc2)N2B(c3ccc(F)cc3)C=C(C)c3cccc1c32,ClCCl,384.0
CC1=CB(c2ccccc2)N2B(c3ccccc3)C=C(C)c3cccc1c32,ClCCl,384.0
CC1=CC(/C=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)=[N+]2C1=C(c1ccc(C(=O)O)cc1)c1c(C)cc(/C=C/c3ccc(-n4c5ccccc5c5ccccc54)cc3)n1[B-]2(F)F,ClCCl,644.0
CC1=CC(/C=C/c2ccc(C)cc2)=[N+]2C1=C(c1ccccc1)c1c(C)cc(/C=C/c3ccc(C)cc3)n1[B-]2(F)F,CC1CCCO1,631.0
CC1=CC(/C=C/c2ccc(N(C)C)cc2)=[N+]2C1=C(c1ccc(C#CCO[C@@H]3O[C@H](CO)[C@@H](O)C(O)[C@H]3O)cc1)c1c(C)cc(/C=C/c3ccc(N(C)C)cc3)n1[B-]2(F)F,CC#N,701.0
CC1=CC(/C=C/c2ccc(N(C)C)cc2)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(/C=C/c3ccc(N(C)C)cc3)n1[B-]2(F)F,CC#N,701.0
CC1=CC(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)=[N+]2C1=C(c1ccc(C(=O)O)cc1)c1c(C)cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)n1[B-]2(F)F,ClCCl,693.0
CC1=CC(/C=C/c2ccc(N3c4ccccc4C=Cc4ccccc43)cc2)=[N+]2C1=C(c1ccc(C(=O)O)cc1)c1c(C)cc(/C=C/c3ccc(N4c5ccccc5C=Cc5ccccc54)cc3)n1[B-]2(F)F,ClCCl,695.0
CC1=CC(/C=C/c2ccc(N3c4ccccc4CCc4ccccc43)cc2)=[N+]2C1=C(c1ccc(C(=O)O)cc1)c1c(C)cc(/C=C/c3ccc(N4c5ccccc5CCc5ccccc54)cc3)n1[B-]2(F)F,ClCCl,703.0
CC1=CC(/C=C/c2ccc(OCCCN=[N+]=[N-])cc2)=[N+]2C1=C(c1ccc(N(C)C)cc1)c1c(C)cc(C)n1[B-]2(F)F,CO,568.0
CC1=CC(/C=C/c2ccc(OCCCN=[N+]=[N-])cc2)=[N+]2C1=C(c1ccc(N3CCCCC3)cc1)c1c(C)cc(C)n1[B-]2(F)F,CO,570.0
CC1=CC(/C=C/c2ccc(OCCCN=[N+]=[N-])cc2)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,CO,564.0
CC1=CC(/C=C/c2ccc(OCCN3CCCCC3)cc2)=[N+]2C1=C(c1ccc(OCCN3CCCCC3)cc1)c1c(C)cc(/C=C/c3ccc(OCCN4CCCCC4)cc3)n1[B-]2(F)F,CCO,639.0
CC1=CC(/C=C/c2ccc(OCCN3CCOCC3)cc2)=[N+]2C1=C(c1ccc(OCCN3CCCCC3)cc1)c1c(C)cc(/C=C/c3ccc(OCCN4CCOCC4)cc3)n1[B-]2(F)F,CCO,638.0
CC1=CC(/C=C/c2ccc([N+](C)(C)C)cc2)=[N+]2C1=C(c1ccc(C#CCO[C@@H]3O[C@H](CO)[C@@H](O)C(O)[C@H]3O)cc1)c1c(C)cc(/C=C/c3ccc([N+](C)(C)C)cc3)n1[B-]2(F)F,CC#N,618.0
CC1=CC(/C=C/c2ccc([N+](C)(C)C)cc2)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(/C=C/c3ccc([N+](C)(C)C)cc3)n1[B-]2(F)F,CC#N,618.0
CC1=CC(/C=C/c2ccc3ccc4cccc5ccc2c3c45)=[N+]2C1=C(c1ccccc1)c1c(C)cc(/C=C/c3ccc4ccc5cccc6ccc3c4c56)n1[B-]2(F)F,CC1CCCO1,691.0
CC1=CC(/C=C/c2ccccc2)=[N+]2C1=C(c1ccccc1)c1c(C)cc(/C=C/c3ccccc3)n1[B-]2(F)F,Cc1ccccc1,629.0
CC1=CC(=C(C#N)C#N)C=C(C=Cc2ccc(N(C)C)cc2)O1,ClC(Cl)Cl,470.0
CC1=CC(=C(C#N)C#N)CC(C)(C)C1,CC#N,639.0
CC1=CC(=C(c2cc(C)c(O)c(CN(C(=O)O)C(=O)O)c2)c2ccccc2S(=O)(=O)O)C=C(CN(C(=O)O)C(=O)O)C1=O,CC(=O)O,430.0
CC1=CC(=O)CCC1,CCO,532.0
CC1=CC(Br)=CN2C[n+]3cc(Br)cc(C)c3N=C12,CO,436.0
CC1=CC(C)(C)N(C)c2cc3c(cc21)C(c1ccc(Br)cc1)=c1cc2c(cc1O3)=[N+](C)C(C)(C)C=C2C,CCO,594.0
CC1=CC(C)(C)N(C)c2cc3c(cc21)C(c1ccc(NC(=O)c2ccc(CCl)cc2)cc1C(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)C=C2C,O,586.0
CC1=CC(C)(C)N(CCCS(=O)(=O)O)c2cc3[o+]c(C(C)(C)C)cc(/C=C/C=C4\N(CCCS(=O)(=O)[O-])c5ccc(S(=O)(=O)O)cc5C4(C)CCCC(=O)O)c3cc21,CCO,653.0
CC1=CC(C)(C)N(CCCS(=O)(=O)O)c2cc3oc(=O)c(C(=O)NCCCCCC(=O)O)cc3cc21,O,444.0
CC1=CC(C)(C)N(CCCS(=O)(=O)[O-])c2cc3[o+]c(-c4ccccc4)cc(/C=C/C=C/C=C4\N(CCCS(=O)(=O)[O-])c5ccc(S(=O)(=O)[O-])cc5C4(C)CCCC(=O)O)c3cc21,CCO,770.0
CC1=CC(C)(C)N(CCCS(=O)(=O)[O-])c2cc3[o+]c(C(C)(C)C)cc(/C=C/C=C/C=C4\N(CCCS(=O)(=O)[O-])c5ccc(S(=O)(=O)[O-])cc5C4(C)CCCC(=O)O)c3cc21,CCO,750.0
CC1=CC(C)(C)N(CCCS(=O)(=O)[O-])c2cc3oc(=O)c(C(=O)NCCCCCC(=O)O)cc3cc21,O,444.0
CC1=CC(C)(C)Nc2ccc3c(-c4cc(C)cc(C)c4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,505.0
CC1=CC(C)(C)Nc2ccc3c(-c4cc(C)cc(C)c4)c4ccc(=[NH2+])cc-4oc3c21,O,535.0
CC1=CC(C)(C)Nc2ccc3c(-c4cc(F)c(F)c(F)c4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,505.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(-c5ccccc5)cc4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,510.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(C(C)(C)C)cc4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,500.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(C)cc4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,500.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(C)cc4)c4ccc(=[NH2+])cc-4oc3c21,O,535.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(C5OCCCO5)cc4)c4ccc(=[NH2+])cc-4oc3c21,O,545.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(CN5CCC6(CC5)OCCO6)cc4)c4ccc(=[NH2+])cc-4oc3c21,O,535.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(CN5CCCCC5)cc4)c4ccc(=[NH2+])cc-4oc3c21,O,540.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(F)c(C)c4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,500.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(F)c(C)c4)c4ccc(=[NH2+])cc-4oc3c21,O,530.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(F)c(Cl)c4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,500.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(F)cc4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,505.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(F)cc4)c4ccc(=[NH2+])cc-4oc3c21,O,540.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(Oc5ccccc5)cc4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,500.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc(Oc5ccccc5)cc4)c4ccc(=[NH2+])cc-4oc3c21,O,535.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc5c(c4)OCO5)c4ccc(=[NH2+])cc-4n(C)c3c21,O,505.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc5ccccc5c4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,500.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccc5ccccc5c4)c4ccc(=[NH2+])cc-4oc3c21,O,540.0
CC1=CC(C)(C)Nc2ccc3c(-c4cccc(CN5CCCCC5)c4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,505.0
CC1=CC(C)(C)Nc2ccc3c(-c4cccc(CN5CCCCC5)c4)c4ccc(=[NH2+])cc-4oc3c21,O,540.0
CC1=CC(C)(C)Nc2ccc3c(-c4cccc(Cl)c4)c4ccc(=[NH2+])cc-4oc3c21,O,540.0
CC1=CC(C)(C)Nc2ccc3c(-c4cccc(F)c4)c4ccc(=[NH2+])cc-4n(C)c3c21,O,500.0
CC1=CC(C)(C)Nc2ccc3c(-c4cccc(F)c4)c4ccc(=[NH2+])cc-4oc3c21,O,540.0
CC1=CC(C)(C)Nc2ccc3c(-c4ccccc4)c4ccc(=[NH2+])cc-4oc3c21,O,535.0
CC1=CC(C)(C)Nc2ccc3c(-c4cccs4)c4ccc(=[NH2+])cc-4oc3c21,O,515.0
CC1=CC(C)=[N+]2C1=C(C)c1cccn1[B-]2(F)F,CCCCCC,492.0
CC1=CC(C)=[N+]2C1=C(C)c1cccn1[B-]2(F)F,CO,486.0
CC1=CC(C)=[N+]2C1=C(C)c1cccn1[B-]2(F)F,ClCCl,488.0
CC1=CC(C)=[N+]2C1=C(C1=C(C)C3=C(C)c4c(C)cc(C)n4[B-](F)(F)[N+]3=C1C)c1c(C)cc(C)n1[B-]2(F)F,ClC(Cl)Cl,516.0
CC1=CC(C)=[N+]2C1=C(C1=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c31)c1c(C)cc(C)n1[B-]2(F)F,ClC(Cl)Cl,515.0
CC1=CC(C)=[N+]2C1=C(c1c(-c3ccccn3)nc3ccccn13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,518.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,C1CCOC1,514.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CC#N,510.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CCCCCC,513.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CCOC(C)=O,512.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CO,511.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,C1CCOC1,514.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CC#N,510.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CCCCCC,514.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CCOC(C)=O,512.0
CC1=CC(C)=[N+]2C1=C(c1c(F)c(F)c(NCCCCNP(=O)(OC(C)C)OC(C)C)c(F)c1F)c1c(C)cc(C)n1[B-]2(F)F,CO,511.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(-c3ccccc3)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CC#N,503.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(-c3ccccc3)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CCCCCC,505.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(-c3ccccc3)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CCO,504.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(-c3ccccc3)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CN(C)C=O,507.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(-c3ccccc3)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,509.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(-c3ccccc3)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,507.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(C)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CC#N,503.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(C)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CCCCCC,505.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(C)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CCO,504.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(C)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CN(C)C=O,506.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(C)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,509.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3c(C)c3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,506.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3cc3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CC#N,502.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3cc3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CCCCCC,504.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3cc3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CCO,505.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3cc3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,CN(C)C=O,505.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3cc3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,508.0
CC1=CC(C)=[N+]2C1=C(c1c3ccccc3cc3ccccc13)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,506.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc1)c1c(C)cc(C)n1[B-]2(F)F,CC#N,499.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc1)c1c(C)cc(C)n1[B-]2(F)F,CCCCCC,502.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc1)c1c(C)cc(C)n1[B-]2(F)F,CCO,500.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc1)c1c(C)cc(C)n1[B-]2(F)F,CN(C)C=O,500.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc1)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,504.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc1)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,502.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3ccc(O)cc3)s1)c1c(C)cc(C)n1[B-]2(F)F,CO,511.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3ccc(O)cc3)s1)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,517.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3ccc(O)cc3)s1)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,514.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3ccc(OS(=O)(=O)c4ccc([N+](=O)[O-])cc4[N+](=O)[O-])cc3)s1)c1c(C)cc(C)n1[B-]2(F)F,CO,512.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3ccc(OS(=O)(=O)c4ccc([N+](=O)[O-])cc4[N+](=O)[O-])cc3)s1)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,518.0
CC1=CC(C)=[N+]2C1=C(c1ccc(-c3ccc(OS(=O)(=O)c4ccc([N+](=O)[O-])cc4[N+](=O)[O-])cc3)s1)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,515.0
CC1=CC(C)=[N+]2C1=C(c1ccc(Br)cc1)c1c(C)cc(/C=C/c3ccc[nH]3)n1[B-]2(F)F,ClCCl,590.0
CC1=CC(C)=[N+]2C1=C(c1ccc(C(=O)OC3C[C@@H]4CC[C@]3(C)C4(C)C)cc1)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,506.0
CC1=CC(C)=[N+]2C1=C(c1ccc(C)cc1)c1c(C)cc(/C=C/c3ccc4ccc5cccc6ccc3c4c56)n1[B-]2(F)F,CC1CCCO1,598.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]2(O)O,ClC(Cl)Cl,504.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]2(OC(C)C)OC(C)C,ClC(Cl)Cl,504.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]2(OCc1ccccc1)OCc1ccccc1,ClC(Cl)Cl,506.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]2(Oc1ccc(Cl)cc1)Oc1ccc(Cl)cc1,ClC(Cl)Cl,506.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]2(Oc1ccc([N+](=O)[O-])cc1)Oc1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,505.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]21OCCO1,ClC(Cl)Cl,507.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]21Oc2ccc3ccccc3c2-c2c(ccc3ccccc23)O1,ClC(Cl)Cl,506.0
CC1=CC(C)=[N+]2C1=C(c1ccc(I)cc1)c1c(C)cc(C)n1[B-]21Oc2ccccc2O1,ClC(Cl)Cl,510.0
CC1=CC(C)=[N+]2C1=C(c1ccc(O)cc1)c1c(C)cc(/C=C/C=C3/N(C)c4ccccc4C3(C)C)n1[B-]2(F)F,O,650.0
CC1=CC(C)=[N+]2C1=C(c1ccc(OCCN3CCCCC3)cc1)c1c(C)cc(C)n1[B-]2(F)F,CCO,500.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,CO,507.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,Cc1ccccc1,513.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)c(-c3cccs3)c(C)n1[B-]2(F)F,ClCCl,511.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(/C=C/c3ccc(N(C)C)cc3)n1[B-]2(F)F,CCOCC,594.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(/C=C/c3ccc(O)cc3)n1[B-]2(F)F,O,565.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,C1CCOC1,500.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,CC#N,497.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,CC(=O)C(C)(C)C,499.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,CC(C)=O,498.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,CCCCCC,501.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,CCOC(C)=O,498.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,CO,497.75
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,Cc1ccccc1,504.0
CC1=CC(C)=[N+]2C1=C(c1ccccc1)c1c(C)cc(C)n1[B-]2(F)F,ClCCl,501.0
CC1=CC(C)=[N+]2C1=Cc1c(C)cc(C)n1[B-]2(F)F,CCCCCC,508.0
CC1=CC(C)=[N+]2C1=Cc1c(C)cc(C)n1[B-]2(F)F,CO,503.0
CC1=CC(C)=[N+]2C1=Cc1c(C)cc(C)n1[B-]2(F)F,ClC(Cl)Cl,509.0
CC1=CC(C)=[N+]2C1=Cc1c(C)cc(C)n1[B-]2(F)F,ClCCl,506.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(-c3[nH]c(C)cc3C)n1[B-]2(F)F,ClCCl,609.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccc(F)cc3)n1[B-]2(F)F,CCCCCC,609.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccc(F)cc3)n1[B-]2(F)F,CCCCCCCCO,613.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccc(F)cc3)n1[B-]2(F)F,CCOC(C)=O,607.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccc(F)cc3)n1[B-]2(F)F,CN(C)C=O,612.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccccc3)n1[B-]2(F)F,CCCCCC,608.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccccc3)n1[B-]2(F)F,CCCCCCCCO,612.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccccc3)n1[B-]2(F)F,CCOC(C)=O,606.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccccc3)n1[B-]2(F)F,CN(C)C=O,612.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccccc3)n1[B-]2(F)F,ClCCl,612.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3cccs3)n1[B-]2(F)F,CCCCCC,621.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3cccs3)n1[B-]2(F)F,CCCCCCCCO,625.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3cccs3)n1[B-]2(F)F,CCOC(C)=O,620.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3cccs3)n1[B-]2(F)F,CN(C)C=O,626.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3cccs3)n1[B-]2(F)F,ClCCl,618.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccsc3)n1[B-]2(F)F,CCCCCC,608.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccsc3)n1[B-]2(F)F,CCCCCCCCO,612.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccsc3)n1[B-]2(F)F,CCOC(C)=O,606.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccsc3)n1[B-]2(F)F,CN(C)C=O,612.0
CC1=CC(C)=[N+]2C1=Cc1c3ccccc3c(C#Cc3ccsc3)n1[B-]2(F)F,ClCCl,612.0
CC1=CC(C)=[N+]2C1=Cc1ccc(/C=C/C=C/c3ccccc3)n1[B-]2(F)F,CO,577.0
CC1=CC(C)=[N+]2C1=Cc1ccc(/C=C/c3ccc(Br)cc3)n1[B-]2(F)F,CCO,562.0
CC1=CC(C)=[N+]2C1=Cc1ccc(/C=C/c3ccc(CO)cc3)n1[B-]2(F)F,CO,560.0
CC1=CC(C)=[N+]2C1=Cc1ccc(CCC(=O)O)n1[B-]2(F)F,CO,502.0
CC1=CC(C)=[N+]2C1=Cc1ccc(CCC(=O)ON3C(=O)CCC3=O)n1[B-]2(F)F,CO,502.0
CC1=CC(C)=[N+]2C1=Cc1cccn1[B-]2(F)F,CCCCCC,493.0
CC1=CC(C)=[N+]2C1=Cc1cccn1[B-]2(F)F,CO,493.0
CC1=CC(C)=[N+]2C1=Cc1cccn1[B-]2(F)F,ClCCl,498.0
CC1=CC(C)=[N+]2C1C(c1ccc(/N=C/c3ccc(O)c(O)c3)cc1)c1c(C)cc(C)n1[B-]2(F)F,ClC(Cl)Cl,508.0
CC1=CC(C)=[N+]2C1C(c1ccc(/N=C/c3cccc(O)c3O)cc1)c1c(C)cc(C)n1[B-]2(F)F,ClC(Cl)Cl,495.0
CC1=CC(C)=[N+]2C1C(c1ccc(O)c(O)c1)c1c(C)cc(C)n1[B-]2(F)F,ClC(Cl)Cl,505.0
CC1=CC(C)N2C1=C(c1ccc(Nc3nc(Nc4ccc(C5=C6C(C)=CC(C)N6[B-](F)(F)[N+]6=C5C(C)=CC6C)cc4)nc(Nc4ccc(-c5c6nc(c(-c7cc(C)c(C)cc7C)c7ccc([nH]7)c(-c7ccc(C(=O)O)cc7)c7nc(c(-c8c(C)cc(C)cc8C)c8ccc5[nH]8)C=C7)C=C6)cc4)n3)cc1)C1=[N+](C(C)C=C1C)[B-]2(F)F,C1CCOC1,420.0
CC1=CC(c2ccc(N(C)C)cc2)=[N+]2C1=Nc1c(C)cc(-c3ccc(N(C)C)cc3)n1[B-]2(F)F,C1CCOC1,744.0
CC1=CC(c2ccc(N(C)C)cc2)=[N+]2C1=Nc1c(C)cc(-c3ccc(N(C)C)cc3)n1[B-]2(F)F,CS(C)=O,774.0
CC1=CC(c2ccc(N(C)C)cc2)=[N+]2C1=Nc1c(C)cc(-c3ccc(N(C)C)cc3)n1[B-]2(F)F,Cc1ccccc1,734.0
CC1=CC(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=C/C(=C2/NC=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)O2)C1=O,Cc1ccccc1,378.0
CC1=CC(c2ccc3ccccc3c2)=[O+][B-]2(OC(=O)C(=O)O2)O1,CC#N,400.0
CC1=CC(c2ccc3ccccc3c2)=[O+][B-]2(OC(=O)C(=O)O2)O1,ClC(Cl)(Cl)Cl,400.0
CC1=CC2=C3C(=C4C(C)=C(c5ccc(-c6nc(-c7ccccc7)c(-c7ccccc7)[nH]6)cc5)S[C@@]4(C)[C@]2(C)S1)C(F)(F)C(F)(F)C3(F)F,C1CCOC1,546.0
CC1=CC2=Nc3nc(C)[n+](C)cc3CN2C=C1,CC#N,403.0
CC1=CC2=Nc3nc(C)[n+](C)cc3CN2C=C1,CCO,398.0
CC1=CC2=Nc3nc(C)[n+](C)cc3CN2C=C1,O,392.0
CC1=CS[C@]2(C)C1=C1C(=C3C(C)=C(c4ccc(-c5nc(-c6ccccc6)c(-c6ccccc6)[nH]5)cc4)S[C@]32C)C(F)(F)C(F)(F)C1(F)F,C1CCOC1,565.0
CC1=C[C@]2(C)C(=C3C(=C4C(C)=C(c5ccc(-c6nc(-c7ccccc7)c(-c7ccccc7)[nH]6)cc5)S[C@]42C)C(F)(F)C(F)(F)C3(F)F)S1,C1CCOC1,505.0
CC1=Cc2ccccc2C1[Fe]C1C(C)=Cc2ccccc21,ClCCl,418.0
CC1=N/C(=C\c2cc(C#N)cc(N(C)C)c2)C(=O)N1C,C1CCOC1,359.0
CC1=N/C(=C\c2cc(C#N)cc(N(C)C)c2)C(=O)N1C,CC#N,354.0
CC1=N/C(=C\c2cc(C#N)cc(N(C)C)c2)C(=O)N1C,CCCCCC,355.0
CC1=N/C(=C\c2cc(N(C)C)ccc2C#N)C(=O)N1C,C1CCOC1,363.0
CC1=N/C(=C\c2cc(N(C)C)ccc2C#N)C(=O)N1C,CC#N,361.0
CC1=N/C(=C\c2cc(N(C)C)ccc2C#N)C(=O)N1C,CCCCCC,359.0
CC1=N/C(=C\c2ccc(C#N)c(N(C)C)c2)C(=O)N1C,C1CCOC1,368.0
CC1=N/C(=C\c2ccc(C#N)c(N(C)C)c2)C(=O)N1C,CC#N,369.0
CC1=N/C(=C\c2ccc(C#N)c(N(C)C)c2)C(=O)N1C,CCCCCC,362.0
CC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1C,C1CCCCC1,405.0
CC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1C,C1CCOC1,419.0
CC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1C,CC#N,422.0
CC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1C,CO,435.0
CC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1C,CS(C)=O,434.0
CC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1C,ClCCl,428.0
CC1=N/C(=C\c2ccc(N(C)C)cc2)C(=O)N1C,O,446.0
CC1=N/C(=C\c2cccc(N(C)C)c2)C(=O)N1C,C1CCOC1,354.0
CC1=N/C(=C\c2cccc(N(C)C)c2)C(=O)N1C,CC#N,353.0
CC1=N/C(=C\c2cccc(N(C)C)c2)C(=O)N1C,CCCCCC,352.0
CC1=N/C(=C\c2ccccc2N)C(=O)N1C,C1CCCCC1,427.0
CC1=N/C(=C\c2ccccc2N)C(=O)N1C,C1CCOC1,430.0
CC1=N/C(=C\c2ccccc2N)C(=O)N1C,CC#N,422.0
CC1=N/C(=C\c2ccccc2N)C(=O)N1C,CO,424.0
CC1=N/C(=C\c2ccccc2N)C(=O)N1C,CS(C)=O,436.0
CC1=N/C(=C\c2ccccc2N)C(=O)N1C,ClCCl,422.0
CC1=N/C(=C\c2ccccc2N)C(=O)N1C,O,390.0
CC1=N/C(=C\c2ccncc2)C(=O)N1C,C1COCCO1,357.0
CC1=N/C(=C\c2ccncc2)C(=O)N1C,CC#N,356.0
CC1=N/C(=C\c2ccncc2)C(=O)N1C,CCO,351.0
CC1=N/C(=C\c2ccncc2)C(=O)N1C,CCOC(C)=O,353.0
CC1=N/C(=C\c2ccncc2)C(=O)N1C,O,347.0
CC1=NC(=Cc2ccc(N(C)C)cc2)C(=O)N1CCN1C(=O)C(=Cc2ccc(N(C)C)cc2)N=C1C,CO,436.0
CC1=NN(c2cccc3ccccc23)[B-](F)(F)[n+]2ccccc21,ClCCl,432.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,C1CCOC1,365.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,C1COCCO1,366.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,CCO,367.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,CCOC(C)=O,364.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,CN(C)C=O,367.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,CO,364.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,CS(C)=O,370.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,Cc1ccccc1,369.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,ClC(Cl)Cl,368.0
CC1=NN(c2ccccc2)C(=O)/C1=C/c1cn(-c2ccccc2)nc1-c1ccccc1,ClCCl,368.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,C1CCOC1,343.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,C1COCCO1,361.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CCO,362.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CCOC(C)=O,359.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CN(C)C=O,361.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CO,360.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CS(C)=O,364.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,Cc1ccccc1,364.0
CC1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,363.0
CC1=NN(c2ccccc2)C(=O)C1=Cc1cn(Cc2ccccc2)c2ccccc12,ClCCl,412.0
CC1=[N+]2C(=C(/C=C/c3ccc(C(F)(F)F)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,620.0
CC1=[N+]2C(=C(/C=C/c3ccc(C(F)(F)F)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,617.5
CC1=[N+]2C(=C(C3=CC4OCCOCCOCCOCCOC4C=C3)c3c4ccccc4c(/C=C/c4ccc(N(C)C)cc4)n3[B-]2(F)F)c2ccccc21,CC#N,693.0
CC1=[N+]2C(=C(NC(C)c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,571.0
CC1=[N+]2C(=C(NC(C)c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,570.0
CC1=[N+]2C(=C(NCc3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,568.0
CC1=[N+]2C(=C(NCc3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,570.0
CC1=[N+]2C(=C(Oc3ccc4c(c3)CC[C@@H]3[C@@H]4CC[C@]4(C)C(=O)CC[C@@H]34)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,579.5
CC1=[N+]2C(=C(Oc3ccc4c(c3)CC[C@@H]3[C@@H]4CC[C@]4(C)C(=O)CC[C@@H]34)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,574.0
CC1=[N+]2C(=C(Oc3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,582.0
CC1=[N+]2C(=C(Oc3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,577.0
CC1=[N+]2C(=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CC#N,514.0
CC1=[N+]2C(=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CCCCCC,516.0
CC1=[N+]2C(=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CCO,516.0
CC1=[N+]2C(=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CN(C)C=O,517.0
CC1=[N+]2C(=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,Cc1ccccc1,519.0
CC1=[N+]2C(=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,ClCCl,518.0
CC1=[N+]2C(=C(c3c4ccccc4c(C)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CC#N,514.0
CC1=[N+]2C(=C(c3c4ccccc4c(C)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CCCCCC,515.0
CC1=[N+]2C(=C(c3c4ccccc4c(C)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CCO,515.0
CC1=[N+]2C(=C(c3c4ccccc4c(C)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,CN(C)C=O,517.0
CC1=[N+]2C(=C(c3c4ccccc4c(C)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,Cc1ccccc1,519.0
CC1=[N+]2C(=C(c3c4ccccc4c(C)c4ccccc34)c3ccc(C)n3[B-]2(F)F)C=C1,ClCCl,517.0
CC1=[N+]2C(=C(c3c4ccccc4cc4ccccc34)c3ccc(/C=C/C(C)(C)C)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,549.0
CC1=[N+]2C(=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC#N,508.0
CC1=[N+]2C(=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCCCCC,512.0
CC1=[N+]2C(=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCO,511.0
CC1=[N+]2C(=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CN(C)C=O,512.0
CC1=[N+]2C(=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,Cc1ccccc1,516.0
CC1=[N+]2C(=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,ClCCl,513.0
CC1=[N+]2C(=C(c3ccc(Br)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,598.5
CC1=[N+]2C(=C(c3ccc(Br)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,601.5
CC1=[N+]2C(=C(c3ccc(C#N)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCCCC1,517.0
CC1=[N+]2C(=C(c3ccc(C#N)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCOC1,516.0
CC1=[N+]2C(=C(c3ccc(C#N)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC#N,512.0
CC1=[N+]2C(=C(c3ccc(C#N)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCOC(C)=O,513.0
CC1=[N+]2C(=C(c3ccc(C#N)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CO,513.0
CC1=[N+]2C(=C(c3ccc(C#N)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,Cc1ccccc1,519.0
CC1=[N+]2C(=C(c3ccc(C#N)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,519.0
CC1=[N+]2C(=C(c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)c3ccc(/C=C/c4ccc(C(=C(c5ccccc5)c5ccccc5)c5ccccc5)cc4)n3[B-]2(F)F)C=C1,C1CCOC1,587.0
CC1=[N+]2C(=C(c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCOC1,511.0
CC1=[N+]2C(=C(c3ccc(C(=O)c4ccccc4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,599.0
CC1=[N+]2C(=C(c3ccc(C(=O)c4ccccc4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,601.5
CC1=[N+]2C(=C(c3ccc(C(OC(=O)c4ccccc4)C(=O)NC(C)(C)C)cc3)c3cc(Br)c(C)n3[B-]2(F)F)C=C1Br,CCOC(C)=O,540.0
CC1=[N+]2C(=C(c3ccc(C(OC(=O)c4ccccc4)C(=O)NC(C)(C)C)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCOC(C)=O,509.5
CC1=[N+]2C(=C(c3ccc(C(OC(=O)c4ccccc4)C(=O)NC(C)(C)C)s3)c3ccc(C)n3[B-]2(F)F)C=C1,CCOC(C)=O,520.5
CC1=[N+]2C(=C(c3ccc(C=O)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,604.5
CC1=[N+]2C(=C(c3ccc(C=O)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,604.5
CC1=[N+]2C(=C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,593.0
CC1=[N+]2C(=C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,596.0
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCCCC1,509.0
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCOC1,505.5
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC#N,504.0
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC(=O)C(C)(C)C,506.0
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC(C)=O,506.0
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCCCCC,506.0
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCOC(C)=O,505.5
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CO,504.5
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,Cc1ccccc1,511.0
CC1=[N+]2C(=C(c3ccc(N4CCCCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,511.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCCCC1,509.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCOC1,507.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC#N,504.5
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC(=O)C(C)(C)C,506.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC(C)=O,505.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCCCCC,508.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCOC(C)=O,506.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,CO,505.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,Cc1ccccc1,511.0
CC1=[N+]2C(=C(c3ccc(N4CCOCC4)cc3)c3ccc(C)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,511.0
CC1=[N+]2C(=C(c3ccccc3)c3c4c(c(C)n3[B-]2(F)F)C2CCC4CC2)C2=C1C1CCC2CC1,CC#N,526.0
CC1=[N+]2C(=C(c3ccccc3)c3c4c(c(C)n3[B-]2(F)F)CCc2ccccc2-4)C2=C1CCc1ccccc12,CC#N,565.0
CC1=[N+]2C(=C(c3ccccc3)c3c4c5ccccc5c5ccccc5c4c(C)n3[B-]2(F)F)c2c1c1ccccc1c1ccccc21,CCCCCC,630.0
CC1=[N+]2C(=C(c3ccccc3)c3c4ccccc4c(C)n3[B-]2(F)F)c2ccccc21,CC#N,597.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(/C=C/c4ccc(C(=C(c5ccccc5)c5ccccc5)c5ccccc5)cc4)n3[B-]2(F)F)C=C1,C1CCOC1,585.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCCCC1,512.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1,C1CCOC1,510.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1,CC#N,507.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1,CCOC(C)=O,508.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1,CO,508.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1,Cc1ccccc1,513.0
CC1=[N+]2C(=C(c3ccccc3)c3ccc(C)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,513.0
CC1=[N+]2C(=C(c3ccccc3C)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,595.0
CC1=[N+]2C(=C(c3ccccc3C)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,599.0
CC1=[N+]2C(=C(c3cccs3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,608.5
CC1=[N+]2C(=C(c3cccs3)c3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,605.0
CC1=[N+]2C(=Cc3c4c(cn3[B-]2(F)F)-c2nc-4c(-c3ccccc3)c3ccc([nH]3)c(-c3ccccc3)c3nc(c(-c4ccccc4)c4ccc([nH]4)c2-c2ccccc2)C=C3)C(C)C1,ClCCl,640.0
CC1=[N+]2C(=Cc3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,C1CCCCC1,592.5
CC1=[N+]2C(=Cc3ccc(C)n3[B-]2(F)F)C=C1c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1c(C)cc(C)cc1C,CCOC(C)=O,589.0
CC1=[N+]2C(=Cc3cccn3[B-]2(F)F)C=C1,CCCCCC,510.0
CC1=[N+]2C(=Cc3cccn3[B-]2(F)F)C=C1,CO,506.0
CC1=[N+]2C(=Cc3cccn3[B-]2(F)F)C=C1,ClCCl,511.0
CC1=[O+][B-]2(OC(=O)C(=O)O2)OC(c2c3ccccc3cc3ccccc23)=C1,CC#N,494.0
CC1=[O+][B-]2(OC(=O)C(=O)O2)OC(c2c3ccccc3cc3ccccc23)=C1,ClC(Cl)(Cl)Cl,494.0
CC1=c2c3c4cccc5cccc(c=3c(C)[n+]2[B-](F)(F)n2c(C)c3c(c21)-c1cccc2cccc-3c12)c54,ClC(Cl)Cl,657.0
CC1=c2c3c4cccc5cccc(c=3c(C)[n+]2[B-](F)(F)n2c(C)c3cc6c(-c7ccccc7)c7c(c(-c8ccccc8)c6cc3c21)-c1cccc2cccc-7c12)c54,ClCCl,658.0
CC1=c2cc3c(C)c4n(c3cc2=[N+]2C1=Cc1c3ccccc3c(C)n1[B-]2(F)F)[B-](F)(F)[N+]1=C(C)c2ccccc2C1=C4,ClC(Cl)Cl,775.0
CC1=c2cc3c(cc2=[N+]2C1=Cc1c4ccccc4c(C)n1[B-]2(F)F)C1=Cc2c4ccccc4c(C)n2[B-](F)(F)[N+]1=C3C,ClC(Cl)Cl,848.0
CC1C(=O)c2c(oc3cc(N(C)C)ccc23)-c2ccccc21,CC#N,537.0
CC1CC(C)(C)N(C)c2cc(CCC(=O)O)c(/C=C/C3=CC(=C(C#N)C#N)CC(C)(C)C3)cc21,ClCCl,533.0
CC1CC(C)(C)N(C)c2ccc(-c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)s3)cc21,CCO,455.0
CC1CC(C)(C)N(C)c2ccc(/C=C/c3cc4sc5cc(/C=C(\C#N)C(=O)O)sc5c4s3)cc21,CN(C)C=O,467.0
CC1CC(C)(C)N(C)c2ccc(/C=C/c3cc[n+](CC(=O)O)cc3)cc21,ClCCl,503.0
CC1CC(C)(C)N(C)c2ccc(/C=C/c3ccc(C=C(C#N)C(=O)O)s3)cc21,CCO,422.0
CC1CC(C)(C)N(C)c2ccc(C=Cc3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)s3)cc21,CCO,475.0
CC1CC(C)(C)N(C)c2ccc(C=Cc3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)cc21,CCO,472.0
CC1CC(C)(C)N(C)c2ccc(C=Cc3ccc(C=C(C#N)C(=O)O)s3)cc21,CCO,468.0
CC1CC(C)(C)N(C)c2ccc(C=Cc3ccc(C=C(C#N)C(=O)O)s3)cc21,ClCCl,525.0
CC1CC(C)(C)N(C)c2ccc(C=Cc3ccc(C=C(C#N)P(=O)(O)O)s3)cc21,CCO,445.0
CC1CC(C)(C)N(Cc2ccccc2)c2ccc(C=Cc3ccc(C=C(C#N)C(=O)O)s3)cc21,CCO,470.0
CC1CC(C)CN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)C1,CCO,612.0
CC1CC(C)CN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)C1,ClC(Cl)Cl,686.0
CC1CC(C)CN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)C1,O,619.0
CC1CC=C(c2ccc(-c3ccc(C#N)s3)s2)CC1,C1CCOC1,357.0
CC1CC=C(c2ccc(-c3ccc(C#N)s3)s2)CC1,CC#N,355.0
CC1CC=C(c2ccc(-c3ccc(C#N)s3)s2)CC1,CCCCCC,356.0
CC1CC=C(c2ccc(-c3ccc(C#N)s3)s2)CC1,CCO,358.0
CC1CC=C(c2ccc(-c3ccc(C#N)s3)s2)CC1,OCCOCCO,366.0
CC1CC=C(c2ccc(-c3ccc(C#N)s3)s2)CC1,c1ccncc1,364.5
CC1CC=C(c2ccc(-c3cccs3)s2)CC1,C1CCOC1,341.0
CC1CC=C(c2ccc(-c3cccs3)s2)CC1,CC#N,341.0
CC1CC=C(c2ccc(-c3cccs3)s2)CC1,CCCCCC,341.0
CC1CC=C(c2ccc(-c3cccs3)s2)CC1,CCO,339.5
CC1CC=C(c2ccc(-c3cccs3)s2)CC1,OCCOCCO,341.0
CC1CC=C(c2ccc(-c3cccs3)s2)CC1,c1ccncc1,343.0
CC1CCC(=CS/C=C/c2ccc(-c3ccc(/C=C/SC=C4CCC(C)CC4)cc3)cc2)CC1,ClCCl,353.0
CC1CCC(=CS/C=C/c2ccc(/C=C/SC=C3CCC(C)CC3)cc2)CC1,ClCCl,350.0
CC1CCC(=CSC=Cc2ccc(-c3ccc(C=CSC=C4CCC(C)CC4)cc3)cc2)CC1,ClCCl,353.0
CC1CCC(=CSC=Cc2ccc(C=CSC=C3CCC(C)CC3)cc2)CC1,ClCCl,350.0
CC1CCC(O)(c2ccc(-c3cccs3)s2)CC1,C1CCOC1,341.0
CC1CCC(O)(c2ccc(-c3cccs3)s2)CC1,CC#N,341.0
CC1CCC(O)(c2ccc(-c3cccs3)s2)CC1,CCCCCC,341.0
CC1CCC(O)(c2ccc(-c3cccs3)s2)CC1,CCO,341.0
CC1CCC(O)(c2ccc(-c3cccs3)s2)CC1,OCCOCCO,345.0
CC1CCC(O)(c2ccc(-c3cccs3)s2)CC1,c1ccncc1,345.0
CC1CCCC(CC(=O)OCCN(C)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)cc2)(CC(=O)OCCN(C)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)C1,C1CCOC1,487.0
CC1CCCC(CC(=O)OCCN(C)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2)(CC(=O)OCCN(C)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2)C1,C1CCOC1,464.0
CC1CCCC(CC(=O)OCCN(C)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)(CC(=O)OCCN(C)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)C1,C1CCOC1,464.0
CC1CCCCC1,CCO,284.3
CC1CCCCN1c1c(F)cc2c(c1F)OC1=C(/C=C/C3=[N+](C)c4ccccc4C3(C)C)CCCC1=C2,CCO,595.0
CC1CCCCN1c1c(F)cc2c(c1F)OC1=C(/C=C/C3=[N+](C)c4ccccc4C3(C)C)CCCC1=C2,ClC(Cl)Cl,610.0
CC1Cc2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)s3)ccc2N1c1ccc(C(C)(C)C)cc1,C1CCOC1,460.0
CC1Cc2ccccc2N1c1ccc(N(c2ccc(/C=C(/C#N)C(=O)O)cc2)c2ccc(N3c4ccccc4CC3C)cc2)cc1,ClC(Cl)Cl,459.0
CC1c2cc(-c3c4ccccc4cc4ccccc34)ccc2-c2cc3nc(-c4ccccc4)c(-c4ccccc4)nc3cc21,CS(C)=O,392.0
CC1c2cc(-c3c4ccccc4cc4ccccc34)ccc2-c2cc3nc4c5cccc6ccc7cccc(c4nc3cc21)c7c65,CS(C)=O,425.0
CC1c2cc(-c3c4ccccc4cc4ccccc34)ccc2-c2cc3nc4c5ccccc5c5ccccc5c4nc3cc21,CS(C)=O,398.0
CC1c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2cc3nc4c5cccc6ccc7cccc(c4nc3cc21)c7c65,CS(C)=O,464.0
CC1c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2cc3nc4c5ccccc5c5ccccc5c4nc3cc21,CS(C)=O,438.0
CC1c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2cc3nc4c5cccc6ccc7cccc(c4nc3cc21)c7c65,CS(C)=O,429.0
CC1c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2cc3nc4c5ccccc5c5ccccc5c4nc3cc21,CS(C)=O,411.0
CC1c2cc(-c3cccc4ccccc34)ccc2-c2cc3nc(-c4ccccc4)c(-c4ccccc4)nc3cc21,CS(C)=O,391.0
CC1c2cc(-c3cccc4ccccc34)ccc2-c2cc3nc4c5cccc6ccc7cccc(c4nc3cc21)c7c65,CS(C)=O,425.0
CC1c2cc(-c3cccc4ccccc34)ccc2-c2cc3nc4c5ccccc5c5ccccc5c4nc3cc21,CS(C)=O,401.0
CC1c2cc(-c3ccccc3)ccc2-c2cc3nc4c5ccccc5c5ccccc5c4nc3cc21,CS(C)=O,403.0
CC1c2cc(-c3nc4cc(C=Cc5ccc(N(c6ccc(C=Cc7ccc8nc(-c9ccc%10c(c9)C(C)(C)c9cc(N(c%11ccccc%11)c%11ccccc%11)ccc9-%10)c(-c9ccc%10c(c9)C(C)(C)c9cc(N(c%11ccccc%11)c%11ccccc%11)ccc9-%10)nc8c7)cc6)c6ccc(C=Cc7ccc8nc(-c9ccc%10c(c9)C(C)(C)c9cc(N(c%11ccccc%11)c%11ccccc%11)ccc9-%10)c(-c9ccc%10c(c9)C(C)(C)c9cc(N(c%11ccccc%11)c%11ccccc%11)ccc9-%10)nc8c7)cc6)cc5)ccc4nc3-c3ccc4c(c3)C(C)(C)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,571.0
CC1c2cc(Br)ccc2-c2cc3c(C#C[Si](C)(C)C)c4ccccc4c(C#C[Si](C)(C)C)c3cc21,ClCCl,457.0
CC1c2cc(Br)ccc2-c2cc3c(C#Cc4ccccc4)c4ccccc4c(C#Cc4ccccc4)c3cc21,ClCCl,481.0
CC1c2cc(C#Cc3ccccc3)ccc2-c2cc3nc4c5cccc6ccc7cccc(c4nc3cc21)c7c65,CS(C)=O,430.0
CC1c2cc(C#Cc3ccccc3)ccc2-c2cc3nc4c5ccccc5c5ccccc5c4nc3cc21,CS(C)=O,407.0
CC1c2cc(C=C(C#N)c3scc4c3OCCO4)ccc2-c2ccc(C=C(C#N)c3scc4c3OCCO4)cc21,CS(C)=O,340.0
CC1c2ccccc2-c2cc3[nH]c(-c4ccc(C(F)(F)F)cc4)nc3cc21,CS(C)=O,359.0
CC1c2ccccc2-c2cc3[nH]c(-c4ccc(Cl)cc4)nc3cc21,CS(C)=O,360.0
CC1c2ccccc2-c2cc3[nH]c(-c4ccc(F)cc4)nc3cc21,CS(C)=O,354.0
CC1c2ccccc2-c2cc3[nH]c(-c4ccc([N+](=O)[O-])cc4)nc3cc21,CS(C)=O,400.0
CC1c2ccccc2-c2cc3[nH]c(-c4ccccc4)nc3cc21,CS(C)=O,356.0
CC1c2ccccc2-c2cc3c(C#C[Si](C)(C)C)c4ccccc4c(C#C[Si](C)(C)C)c3cc21,ClCCl,456.0
CC1c2ccccc2-c2cc3c(C#Cc4ccccc4)c4ccccc4c(C#Cc4ccccc4)c3cc21,ClCCl,480.0
CC1c2ccccc2-c2cc3nc(-c4ccccc4)c(-c4ccccc4)nc3cc21,CS(C)=O,385.0
CCC(=O)NC1=CC(=O)C(=O)c2ccccc21,CCO,267.0
CCC(=O)Nc1ccc(-c2c(C)c3ccc(N(CC)CC)cc3oc2=O)cc1,CO,384.0
CCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,427.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,C1CCCCC1,342.3333333333333
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,C1CCOC1,346.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,C1COCCO1,348.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CC(C)=O,350.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CC(C)O,367.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CC(O)CO,370.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CCC(C)=O,367.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CCCCCC,338.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CCCCCCC,343.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CCCCCCCCO,360.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CCN(CC)CC,343.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CCO,363.6666666666667
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CCOC(C)=O,352.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CN(C)C=O,352.5
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,CO,362.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,Cc1ccccc1,348.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,ClC(Cl)Cl,357.5
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,ClCCl,356.5
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,O,362.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,OCC(O)CO,370.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,OCCO,375.0
CCC(=O)c1ccc2cc(N(C)C)ccc2c1,c1ccccc1,355.0
CCC(C)(C)c1ccc(-c2ccc(-c3ccc(C(C)(C)CC)cc3)cc2)cc1,C1COCCO1,289.0
CCC(C)(C)c1ccc(-c2ccc(-c3ccccc3)cc2)cc1,C1COCCO1,287.0
CCC(C)(C)c1ccc(-c2ccc3c(c2)C(CCOC)(CCOC)c2cc(C(C)(C)CC)ccc2-3)cc1,C1CCCCC1,318.0
CCC(C)(C)c1ccc(-c2ccc3c(c2)C(CCOC)(CCOC)c2cc4c(cc2-3)C(CCOC)(CCOC)c2cc(-c3ccc(C(C)(C)CC)cc3)ccc2-4)cc1,C1CCCCC1,366.0
CCC(C)(C)c1ccc2c(c1)C(CC)(CC)c1cc(-c3ccc4c(c3)C(CC)(CC)c3cc(C(C)(C)CC)ccc3-4)ccc1-2,C1CCCCC1,331.0
CCC(C)(C)c1ccc2c(c1)C(CCOC)(CCOC)c1cc(-c3ccc4c(c3)C(CCOC)(CCOC)c3cc(C(C)(C)CC)ccc3-4)ccc1-2,C1CCCCC1,331.0
CCC(C)(C)c1ccc2oc3ccccc3c(=O)c2c1,CCOC(C)=O,642.0
CCC(C)(C)c1ccc2oc3ccccc3c(=O)c2c1C(C)(C)CC,CCOC(C)=O,654.0
CCC(C)CN1c2ccccc2Sc2cc(-c3cc4sc(C5=C6C(=O)N(C)C(c7csc8cc(-c9ccc%10c(c9)Sc9ccccc9N%10CC(C)CC)sc78)=C6C(=O)N5C)cc4s3)ccc21,ClCCl,677.0
CCC(C)CN1c2ccccc2Sc2cc(-c3ccc(C4=C5C(=O)N(C)C(c6ccc(-c7ccc8c(c7)Sc7ccccc7N8CC(C)CC)s6)=C5C(=O)N4C)s3)ccc21,ClCCl,664.0
CCC(C)CN1c2ccccc2Sc2cc(-c3cnc(C4=C5C(=O)N(C)C(c6ncc(-c7ccc8c(c7)Sc7ccccc7N8CC(C)CC)s6)=C5C(=O)N4C)s3)ccc21,ClCCl,655.0
CCC(C)COc1ccc(-c2ccc3c(c2)Sc2cc(-c4cc5sc(C6=C([O-])C(=CC7=[N+](C)c8ccc(C(=O)O)cc8C7(C)C)C6=O)cc5s4)ccc2N3C)cc1,C1CCOC1,662.0
CCC(C)Nc1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,ClCCl,456.0
CCC(C)Oc1c2cc(-c3ccc4c5nc6ccccc6nc5n(C)c4c3)sc2c(OC(C)CC)c2cc(-c3ccc4c5nc6ccccc6nc5n(C)c4c3)sc12,ClC(Cl)Cl,500.0
CCC(C)[Si](C#Cc1c2cc3cc4c(cc3cc2c(C#C[Si](C(C)CC)(C(C)CC)C(C)CC)c2cc3cc5cc6c(cc5cc3cc12)OC(CC(C)C)(CC(C)C)O6)OC(CC(C)C)(CC(C)C)O4)(C(C)CC)C(C)CC,CCCCCC,719.3773484
CCC(C)[Si](C#Cc1c2nc3c4ccccc4c(=O)c4ccccc4c3nc2c(C#C[Si](C(C)CC)(C(C)CC)C(C)CC)c2nc3c4ccccc4c(=O)c4ccccc4c3nc12)(C(C)CC)C(C)CC,ClCCl,544.0
CCC(CC)CCCCOc1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(C5=CC=C(/C=C(\C#N)C(=O)O)C5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)ccc2N3CCCCC(CC)CC)cc1,C1CCOC1,471.0
CCC(CC)CCCCOc1ccc2cc(-c3ccc(-c4ccc5c(c4)Sc4cc(-c6ccc(C7=CC=C(/C=C(/C#N)C(=O)O)C7)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)ccc4N5CCCCC(CC)CC)cc3)ccc2c1,C1CCOC1,466.0
CCC(CC)CCCCOc1ccc2ccccc2c1-c1c(OCCCCC(CC)CC)ccc2cc(-c3ccc(-c4ccc5c(c4)Sc4cc(-c6ccc(C7=CC=C(/C=C(/C#N)C(=O)O)C7)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)ccc4N5CCCCC(CC)CC)cc3)ccc12,C1CCOC1,472.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5ccccc5)n4[B-](F)(F)[n+]4c3n(c3cc(C(C)(C)C)ccc34)[B-](F)(F)[N+]2=C1c1ccccc1,C1CCOC1,702.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5ccccc5)n4[B-](F)(F)[n+]4c3n(c3cc(C(C)(C)C)ccc34)[B-](F)(F)[N+]2=C1c1ccccc1,CC#N,694.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5ccccc5)n4[B-](F)(F)[n+]4c3n(c3cc(C(C)(C)C)ccc34)[B-](F)(F)[N+]2=C1c1ccccc1,ClCCl,703.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5ccccc5)n4[B-](F)(F)[n+]4nnn(c43)[B-](F)(F)[N+]2=C1c1ccccc1,C1CCOC1,691.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5ccccc5)n4[B-](F)(F)[n+]4nnn(c43)[B-](F)(F)[N+]2=C1c1ccccc1,CC#N,687.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5ccccc5)n4[B-](F)(F)[n+]4nnn(c43)[B-](F)(F)[N+]2=C1c1ccccc1,ClCCl,700.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5cccs5)n4[B-](F)(F)[n+]4nnn(c43)[B-](F)(F)[N+]2=C1c1cccs1,C1CCOC1,784.0
CCC(CC)COC1=CC2=C3c4cc(OCC(CC)CC)c(-c5cccs5)n4[B-](F)(F)[n+]4nnn(c43)[B-](F)(F)[N+]2=C1c1cccs1,ClCCl,795.0
CCC(CC)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(C(CC)CC)C5=O,Cc1ccccc1,525.0
CCC(CC)c1ccc2cc3c([o+]c2c1)/C(=C/Cc1ccccc1)CCC3,CCO,604.0
CCC(CC)c1ccc2cc3c([o+]c2c1)/C(=C/Cc1ccccc1)CCC3,ClC(Cl)Cl,616.0
CCC(CC)c1ccc2cc3c([o+]c2c1)/C(=C/Cc1ccccc1)CCC3,ClCCl,615.0
CCC(CC)n1c2ccccc2c2cc3c(cc21)c1ccccc1n3C(CC)CC,ClC(Cl)Cl,419.0
CCC(COC1C=CC=CC1=NC1c2cccnc2-c2ncccc21)(COC1C=CC=CC1=NC1c2cccnc2-c2ncccc21)COC1C=CC=CC1=NC1c2cccnc2-c2ncccc21,ClC(Cl)Cl,432.0
CCC/C=C/C=C/c1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,453.0
CCC1(C)C(=O)c2cc3[nH]c4c(c5nc(cc6[nH]c(cc1n2)c(/C=C/C(=O)O)c6C)C(C)=C5CCC(=O)OC)CC(=O)c4c3C,CCO,690.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc(C=C4c5ccccc5-c5ccccc54)cc3)cc21,ClCCl,470.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)n4C)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,462.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)o4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,457.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)n3C)ccc2-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc21,C1CCOC1,475.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)n3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,475.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(N(c5ccccc5)c5ccc6c(c5)C(CC)(CC)c5cc(-c7ccc(-c8ccc(/C=C(\C#N)C(=O)O)s8)s7)ccc5-6)ccc3-4)cc21,C1CCOC1,465.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)cc21,C1CCOC1,468.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc21,C1CCOC1,470.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,487.0
CCC1(CC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,ClCCl,465.0
CCC1(CC)c2cc(-c3ccc(-c4ccc5c(c4)C(CC)(CC)c4cc(C(C)(C)C)ccc4-5)cc3)ccc2-c2ccc(C(C)(C)C)cc21,CO,332.4152542
CCC1(CC)c2cc(-c3ccc(-c4ccccc4)cc3-c3ccccc3)ccc2-c2cc3c(cc21)-c1ccc(-c2ccc(-c4ccccc4)cc2-c2ccccc2)cc1C3(CC)CC,C1CCOC1,366.0
CCC1(CC)c2cc(-c3ccc(-c4ccccc4)cc3-c3ccccc3)ccc2-c2nc3c(nc21)-c1ccc(-c2ccc(-c4ccccc4)cc2-c2ccccc2)cc1C3(CC)CC,C1CCOC1,398.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,ClCCl,374.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,ClCCl,406.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(-c3ccc(-c4ccc5c(c4)C(CC)(CC)c4cc(-c6ccc(-c7ccc8c(c7)C(CC)(CC)c7cc(N(c9ccccc9)c9cccc%10ccccc9%10)ccc7-8)s6)ccc4-5)s3)cc21,C1CCOC1,423.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3c4ccccc4cc4ccccc34)cc21,C1CCOC1,421.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc(C=C(C#N)C#N)cc3)cc21,ClCCl,460.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc(C=C4c5ccccc5-c5ccccc54)cc3)cc21,ClCCl,464.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(N(c5ccccc5)c5ccc6c(c5)C(CC)(CC)c5cc(-c7ccc(/C=C(\C#N)C(=O)O)s7)ccc5-6)ccc3-4)cc21,C1CCOC1,453.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)cc21,C1CCOC1,425.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc21,C1CCOC1,420.6666666666667
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,424.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,408.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC(C)=O,406.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,469.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,ClCCl,429.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)c4ccc(C=C(C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,505.0
CCC1(CC)c2cc(-c3ccc(/C=C(\C#N)c4ccc(C=C(C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,500.0
CCC1(CC)c2cc(-c3ccc(C(C)(C)C)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc6c(c5)C(CC)(CC)c5cc(-c7ccc(C(C)(C)C)cc7)ccc5-6)ccc3-4)cc21,CO,360.5427975
CCC1(CC)c2cc(-c3ccc(C=C(C#N)C#N)s3)ccc2-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc21,CC#N,492.0
CCC1(CC)c2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)cc21,C1CCOC1,458.0
CCC1(CC)c2cc(-c3ccc4c(c3)C(CC)(CC)c3cc(C(C)(C)C)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(CC)(CC)c3cc(C(C)(C)C)ccc3-4)cc21,CO,349.5762712
CCC1(CC)c2cc(-c3cccs3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(-c4cccs4)ccc2-3)C(CC)(CC)c2cc(-c3cccs3)ccc2-1,C1CCOC1,340.0
CCC1(CC)c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2ccc(-n3c4ccccc4c4cc(/C=C(\C#N)C(=O)O)ccc43)cc21,ClCCl,403.0
CCC1(CC)c2cc(/C=C(\C#N)C(=O)O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,424.0
CCC1(CC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(/C=C\C(c4ccc(N(C)C)cc4)c4ccc(N(C)C)cc4)cc3)cc21,ClC(Cl)Cl,521.0
CCC1(CC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClC(Cl)Cl,491.0
CCC1(CC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCCO4)cc21,ClC(Cl)Cl,519.0
CCC1(CC)c2cc(/C=C(\C#N)c3ccc(C=C(C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,482.0
CCC1(CC)c2cc(/C=C(\C#N)c3ccc(C=C(C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,488.0
CCC1(CC)c2cc(/C=C/c3cc(Br)c(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3Br)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,C1CCOC1,439.9145299
CCC1(CC)c2cc(/C=C/c3cc(Br)c(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3Br)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,CC#N,435.8119658
CCC1(CC)c2cc(/C=C/c3cc(Br)c(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3Br)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,CCCCCC,433.4188034
CCC1(CC)c2cc(/C=C/c3cc(Br)c(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3Br)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,Cc1ccccc1,439.9145299
CCC1(CC)c2cc(/C=C/c3cc(Br)c(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3Br)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,ClCCl,426.0
CCC1(CC)c2cc(/C=C/c3cc(C#N)c(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3C#N)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,ClCCl,419.0
CCC1(CC)c2cc(/C=C/c3ccc(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,C1CCOC1,444.7278912
CCC1(CC)c2cc(/C=C/c3ccc(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,CC#N,441.4965986
CCC1(CC)c2cc(/C=C/c3ccc(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,CCCCCC,440.6462585
CCC1(CC)c2cc(/C=C/c3ccc(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,Cc1ccccc1,446.4285714
CCC1(CC)c2cc(/C=C/c3ccc(/C=C/c4ccc5c(c4)C(CC)(CC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)cc3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,ClCCl,418.0
CCC1(CC)c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,Cc1ccccc1,412.0
CCC1(CC)c2cc(/C=C/c3cccs3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(/C=C/c4cccs4)ccc2-3)C(CC)(CC)c2cc(/C=C/c3cccs3)ccc2-1,C1CCOC1,386.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,C1CCOC1,362.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CC#N,359.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CC(C)=O,360.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CCCCCC,362.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,Cc1ccccc1,364.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,C1CCOC1,362.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CC#N,359.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CC(C)=O,360.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CCCCCC,361.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CCCO,360.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,CCO,360.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,Cc1ccccc1,363.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-1,ClC(Cl)Cl,364.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,C1CCOC1,362.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CC#N,359.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CC(C)=O,360.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CCCCCC,362.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CCCO,360.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CCO,360.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,Cc1ccccc1,363.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,ClC(Cl)Cl,363.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc3-4)cc21,C1CCOC1,422.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc3-4)cc21,CC#N,417.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc3-4)cc21,CC(C)=O,418.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc3-4)cc21,CCCCCC,422.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc3-4)cc21,CN(C)C=O,422.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc3-4)cc21,Cc1ccccc1,424.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)ccc3-4)cc21,ClC(Cl)Cl,422.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,400.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,394.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC(C)=O,398.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCCCCC,401.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CN(C)C=O,396.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,403.0
CCC1(CC)c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClC(Cl)Cl,402.0
CCC1(CC)c2cc(Br)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(-c4cccs4)ccc2-3)C(CC)(CC)c2cc(-c3cccs3)ccc2-1,C1CCOC1,338.0
CCC1(CC)c2cc(Br)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(-c4cccs4)ccc2-3)C(CC)(CC)c2cc(Br)ccc2-1,C1CCOC1,336.0
CCC1(CC)c2cc(C#Cc3ccc(/C=C(\C#N)C(=O)O)cc3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,384.0
CCC1(CC)c2cc(C#Cc3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,396.0
CCC1(CC)c2cc(C#Cc3ccc(C=C(C#N)C#N)cc3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,626.4
CCC1(CC)c2cc(C#Cc3ccc(C=C(C#N)C#N)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,632.3
CCC1(CC)c2cc(C#Cc3ccc(C=C(C#N)C(=O)O)cc3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,583.0
CCC1(CC)c2cc(C#Cc3cccc(/C=C(\C#N)C(=O)O)c3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,375.0
CCC1(CC)c2cc(C#Cc3cccc(C=C(C#N)C(=O)O)c3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,418.1
CCC1(CC)c2cc(C=C(C#N)C#N)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,518.6
CCC1(CC)c2cc(C=C(C#N)C(=O)O)ccc2-c2ccc(-c3ccc(-c4ccc5ccc6cccc7ccc4c5c67)s3)cc21,C1CCOC1,508.1
CCC1(CC)c2cc(C=C(C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccc(N(C)C)cc4)c4ccc(N(C)C)cc4)cc3)cc21,ClC(Cl)Cl,521.0
CCC1(CC)c2cc(C=O)ccc2-c2ccc(N(C)C)cc21,C1CCCCC1,385.0
CCC1(CC)c2cc(C=O)ccc2-c2ccc(N(C)C)cc21,CC#N,385.0
CCC1(CC)c2cc(C=O)ccc2-c2ccc(N(C)C)cc21,CCO,388.0
CCC1(CC)c2cc(C=O)ccc2-c2ccc(N(C)C)cc21,CCOCC,379.0
CCC1(CC)c2cc(C=O)ccc2-c2ccc(N(C)C)cc21,CS(C)=O,395.0
CCC1(CC)c2cc(C=O)ccc2-c2ccc(N(C)C)cc21,ClCCl,392.0
CCC1(CC)c2cc(C=O)ccc2-c2ccc(N(C)C)cc21,c1ccccc1,388.0
CCC1(CC)c2cc(Cn3c(-c4ccccc4)nc(-c4ccccc4)c3-c3ccccc3)ccc2-c2ccc(Cn3c(-c4ccccc4)nc(-c4ccccc4)c3-c3ccccc3)cc21,CO,312.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc4ccc5cccc6ccc3c4c56)cc21,C1CCOC1,415.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc4ccc5cccc6ccc3c4c56)cc21,CC#N,420.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc4ccc5cccc6ccc3c4c56)cc21,CO,410.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc4ccc5cccc6ccc3c4c56)cc21,Cc1ccccc1,419.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc4ccc5cccc6ccc3c4c56)cc21,ClCCl,417.0
CCC1(CC)c2cc(N(c3ccccc3)c3cccc4ccccc34)ccc2-c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3cccc4ccccc34)cc21,ClCCl,441.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,C1CCOC1,363.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CC#N,359.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CC(C)=O,361.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CCCCCC,364.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,Cc1ccccc1,366.0
CCC1(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-c2ccc(N(c3ccccc3)c3ccc(/C=C(\C#N)C(=O)O)cc3)cc21,ClCCl,447.0
CCC1(CC)c2ccc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,544.0
CCC1(CC)c2ccc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,534.0
CCC1(CC)c2ccc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,547.0
CCC1(CC)c2ccc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClC(Cl)Cl,580.0
CCC1(CC)c2ccc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,565.0
CCC1(CC)c2ccc(/C=C/C3=C(S(=O)(=O)c4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,537.0
CCC1(CC)c2ccc(/C=C/C3=C(S(=O)(=O)c4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,534.0
CCC1(CC)c2ccc(/C=C/C3=C(S(=O)(=O)c4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,534.0
CCC1(CC)c2ccc(/C=C/C3=C(S(=O)(=O)c4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClC(Cl)Cl,570.0
CCC1(CC)c2ccc(/C=C/C3=C(S(=O)(=O)c4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,560.0
CCC1(CC)c2ccc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,490.0
CCC1(CC)c2ccc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,490.0
CCC1(CC)c2ccc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC(C)=O,487.0
CCC1(CC)c2ccc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CS(C)=O,498.0
CCC1(CC)c2ccc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,486.0
CCC1(CC)c2ccc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClC(Cl)Cl,509.0
CCC1(CC)c2ccc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,504.0
CCC1(CC)c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc2-3)C(CC)(CC)c2ccc(C=C(C#N)C(=O)O)cc2-1,C1CCOC1,388.0
CCC1(CC)c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)s5)ccc3-4)cc2-c2ccc(C(c3ccccc3)c3ccccc3)cc21,C1CCOC1,468.0
CCC1(CC)c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(/C=C(/C#N)C(=O)O)s5)ccc3-4)cc2-c2ccc(C(c3ccccc3)c3ccccc3)cc21,C1CCOC1,458.0
CCC1(CC)c2ccc(N(c3ccccc3)c3ccccc3)cc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2-1,C1CCOC1,398.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(-c4cccs4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,C1CCOC1,355.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(/C=C/c4cccs4)ccc2-3)C(CC)(CC)c2cc(/C=C/c3cccs3)ccc2-1,C1CCOC1,382.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(/C=C/c4cccs4)ccc2-3)C(CC)(CC)c2ccccc2-1,C1CCOC1,382.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2ccccc2-1,C1CCOC1,358.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2ccccc2-1,CC#N,356.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2ccccc2-1,CC(C)=O,357.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2ccccc2-1,CCCCCC,358.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)ccc2-3)C(CC)(CC)c2ccccc2-1,ClC(Cl)Cl,361.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,C1CCOC1,360.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CC#N,357.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CC(C)=O,358.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,CCCCCC,360.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2cc(N(c3ccccc3)c3ccccc3)ccc2-1,Cc1ccccc1,362.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2ccccc2-1,C1CCOC1,356.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2ccccc2-1,CC#N,353.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2ccccc2-1,CC(C)=O,354.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2ccccc2-1,CCCCCC,356.0
CCC1(CC)c2ccccc2-c2c1c1c(c3c2C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CC)(CC)c2ccccc2-1,Cc1ccccc1,360.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(CC)(CC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(CC)(CC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(CC)(CC)c6ccccc6-7)c6ccc3c4c65)cc21,Cc1ccccc1,488.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,C1CCCCC1,401.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,C1CCOC1,402.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,CC#N,399.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,CCOC(C)=O,400.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,CN(C)C=O,404.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,Cc1ccccc1,405.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,ClC(Cl)Cl,404.0
CCC1(CC)c2ccccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,ClCCl,403.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc(C=C(C#N)c4ccc(C=C(C#N)C(=O)O)s4)cc3)c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)cc21,C1CCOC1,511.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc(C=C(C#N)c4ccc(C=C(C#N)C(=O)O)s4)cc3)c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)cc21,Cc1ccccc1,530.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc(C=C(C#N)c4ccc(C=C(C#N)C(=O)O)s4)s3)cc21,C1CCOC1,560.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc(C=C(C#N)c4ccc(C=C(C#N)C(=O)O)s4)s3)cc21,Cc1ccccc1,578.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc3-4)cc21,ClCCl,513.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)ccc3-4)cc21,ClCCl,513.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)cc21,ClCCl,492.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(C=C(C#N)C(=O)O)s5)ccc3-4)cc21,ClCCl,492.0
CCC1(CC)c2ccccc2-c2ccc(N(c3ccccc3)c3ccc(/C=C(\C#N)C(=O)O)cc3)cc21,ClCCl,440.0
CCC1(CC)c2ccccc2-c2ccc(N3c4ccccc4Sc4ccc(/C=C(/C#N)C(=O)O)cc43)cc21,ClCCl,476.0
CCC1(CC)c2ccccc2-c2ccc(N3c4ccccc4Sc4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)cc43)cc21,ClCCl,496.0
CCC1(CC)c2ccccc2-n2c3ccc(-c4ccc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)s4)cc3c3cccc1c32,C1CCOC1,474.0
CCC1(CC)c2ccccc2-n2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)cc3c3cccc1c32,C1CCOC1,483.0
CCC1(CC)c2ccccc2-n2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)cc3c3cccc1c32,C1CCOC1,464.0
CCC1(CC)c2ccccc2-n2c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3c3cccc1c32,C1CCOC1,367.0
CCC1(CC)c2ccccc2-n2c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3c3cccc1c32,C1CCOC1,440.0
CCC12C(=C3C(=C4c5ccc(-c6ccc(C(C)=O)cc6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C(C)=O)cc3)cc1S2(=O)=O,C1COCCO1,456.0
CCC12C(=C3C(=C4c5ccc(-c6ccc(C(C)=O)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C(C)=O)s3)cc1S2(=O)=O,C1COCCO1,485.0
CCC12C(=C3C(=C4c5ccc(-c6ccc(C)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C)s3)cc1S2(=O)=O,C1COCCO1,506.0
CCC12C(=C3C(=C4c5ccc(-c6ccc(C)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C)s3)cc1S2(=O)=O,CC#N,507.0
CCC12C(=C3C(=C4c5ccc(-c6ccc(C)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C)s3)cc1S2(=O)=O,CCCCCC,489.0
CCC12C(=C3C(=C4c5ccc(-c6ccc(C)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C)s3)cc1S2(=O)=O,CCO,508.0
CCC12C(=C3C(=C4c5ccc(-c6ccc(C)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C)s3)cc1S2(=O)=O,CS(C)=O,525.3687316
CCC12C(=C3C(=C4c5ccc(-c6ccc(C)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C)s3)cc1S2(=O)=O,ClC(Cl)(Cl)Cl,497.3451327
CCC12C(=C3C(=C4c5ccc(-c6ccc(C)s6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(C)s3)cc1S2(=O)=O,ClCCl,507.6696165
CCC12C(=C3C(=C4c5ccc(-c6ccc(CO)cc6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccc(CO)cc3)cc1S2(=O)=O,C1COCCO1,463.0
CCC12C(=C3C(=C4c5ccc(-c6ccccc6)cc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccc(-c3ccccc3)cc1S2(=O)=O,C1COCCO1,456.0
CCC12C(=C3C(=C4c5ccccc5S(=O)(=O)C41CC)C(F)(F)C(F)(F)C3(F)F)c1ccccc1S2(=O)=O,C1COCCO1,414.0
CCC1=C(C)C(=O)NC1=Cc1[nH]c(C(C)(C)c2[nH]c(C=C3C=C(C)C(=O)N3)c(C)c2C(=O)O)c(C(=O)O)c1C,c1ccccc1,445.0
CCC1=C(C)C(=O)NC1=Cc1[nH]c(C(C)(C)c2[nH]c(C=C3NC(=O)C(C)=C3CC)c(C)c2C(=O)OC)c(CC(=O)OC)c1C,c1ccccc1,434.0
CCC1=C(C)C(=O)NC1=Cc1[nH]c(C(C)(C)c2[nH]c(C=C3NC(=O)C(C)=C3CC)c(C)c2CC(=O)O)c(CC(=O)O)c1C,c1ccccc1,438.0
CCC1=C(C)C(=O)NC1=Cc1[nH]c(C(C)(C)c2[nH]c(C=C3NC(=O)C(C)=C3CC)c(C)c2CC(=O)OC)c(CC(=O)OC)c1C,c1ccccc1,420.0
CCC1=C(C)C(=O)NC1=Cc1[nH]c(C(C)(C)c2[nH]c(C=C3NC(=O)C(C)=C3CC)c(C)c2CCC(=O)O)c(CCC(=O)O)c1C,c1ccccc1,439.0
CCC1=C(C)C(=O)NC1=Cc1[nH]c(C(C)(C)c2[nH]c(C=C3NC(=O)C(C)=C3CC)c(C)c2CCC(=O)OC)c(CCC(=O)OC)c1C,c1ccccc1,428.0
CCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC(C)(C)C)c(C)c1c2=O,C1CCCCC1,392.0
CCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC(C)(C)C)c(C)c1c2=O,CO,397.0
CCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC(C)(C)C)c(C)c1c2=O,CS(C)=O,397.0
CCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC(C)(C)C)c(C)c1c2=O,ClC(Cl)Cl,397.0
CCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC(C)(C)C)c(C)c1c2=O,c1ccccc1,396.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)O)c(C)n1c2=O,CC#N,417.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)O)c(C)n1c2=O,CC(C)=O,417.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)O)c(C)n1c2=O,CO,425.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)O)c(C)n1c2=O,CS(C)=O,423.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)O)c(C)n1c2=O,ClC(Cl)Cl,424.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)O)c(C)n1c2=O,c1ccccc1,424.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)OC)c(C)n1c2=O,CC#N,413.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)OC)c(C)n1c2=O,CC(C)=O,413.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)OC)c(C)n1c2=O,CO,420.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)OC)c(C)n1c2=O,CS(C)=O,421.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)OC)c(C)n1c2=O,ClC(Cl)Cl,423.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC(=O)OC)c(C)n1c2=O,c1ccccc1,416.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC)c(C)n1c2=O,CC#N,423.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC)c(C)n1c2=O,CC(C)=O,422.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC)c(C)n1c2=O,CO,428.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC)c(C)n1c2=O,CS(C)=O,428.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC)c(C)n1c2=O,ClC(Cl)Cl,432.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CC)c(C)n1c2=O,c1ccccc1,428.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)O)c(C)n1c2=O,CC#N,408.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)O)c(C)n1c2=O,CC(C)=O,413.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)O)c(C)n1c2=O,CO,425.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)O)c(C)n1c2=O,CS(C)=O,426.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)O)c(C)n1c2=O,ClC(Cl)Cl,428.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)O)c(C)n1c2=O,c1ccccc1,421.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)OC)c(C)n1c2=O,CC#N,420.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)OC)c(C)n1c2=O,CC(C)=O,420.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)OC)c(C)n1c2=O,CO,424.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)OC)c(C)n1c2=O,CS(C)=O,425.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)OC)c(C)n1c2=O,ClC(Cl)Cl,427.0
CCC1=C(C)C(=O)n2c1cc1c(C)c(CCC(=O)OC)c(C)n1c2=O,c1ccccc1,420.0
CCC1=C(C)C(=O)n2c1cc1c(C)cc(C)n1c2=O,CC#N,409.0
CCC1=C(C)C(=O)n2c1cc1c(C)cc(C)n1c2=O,CC(C)=O,412.0
CCC1=C(C)C(=O)n2c1cc1c(C)cc(C)n1c2=O,CO,420.0
CCC1=C(C)C(=O)n2c1cc1c(C)cc(C)n1c2=O,CS(C)=O,420.0
CCC1=C(C)C(=O)n2c1cc1c(C)cc(C)n1c2=O,ClC(Cl)Cl,420.0
CCC1=C(C)C(=O)n2c1cc1c(C)cc(C)n1c2=O,c1ccccc1,423.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)O)c(C)c(C)n1c2=O,CC#N,416.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)O)c(C)c(C)n1c2=O,CC(C)=O,415.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)O)c(C)c(C)n1c2=O,CO,421.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)O)c(C)c(C)n1c2=O,CS(C)=O,421.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)O)c(C)c(C)n1c2=O,ClC(Cl)Cl,423.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)O)c(C)c(C)n1c2=O,c1ccccc1,419.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)OC)c(C)c(C)n1c2=O,CC#N,420.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)OC)c(C)c(C)n1c2=O,CC(C)=O,420.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)OC)c(C)c(C)n1c2=O,CO,426.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)OC)c(C)c(C)n1c2=O,CS(C)=O,427.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)OC)c(C)c(C)n1c2=O,ClC(Cl)Cl,429.0
CCC1=C(C)C(=O)n2c1cc1c(CCC(=O)OC)c(C)c(C)n1c2=O,c1ccccc1,425.0
CCC1=C(C)C(=O)n2c1cc1c(c(C)c(C(=O)OCC(C)C)n1CC(C)C)c2=O,C1CCCCC1,397.0
CCC1=C(C)C(=O)n2c1cc1c(c(C)c(C(=O)OCC(C)C)n1CC(C)C)c2=O,CO,397.0
CCC1=C(C)C(=O)n2c1cc1c(c(C)c(C(=O)OCC(C)C)n1CC(C)C)c2=O,CS(C)=O,397.0
CCC1=C(C)C(=O)n2c1cc1c(c(C)c(C(=O)OCC(C)C)n1CC(C)C)c2=O,ClC(Cl)Cl,399.0
CCC1=C(C)C(=O)n2c1cc1c(c(C)c(C(=O)OCC(C)C)n1CC(C)C)c2=O,c1ccccc1,397.0
CCC1=C(C)C2=C(/C=C/Sc3ccccc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,528.0
CCC1=C(C)C2=C(/C=C/c3ccc([N+](=O)[O-])cc3)c3c(C)c(CC)c(/C=C/c4ccc(OC)cc4)n3[B-](F)(F)[N+]2=C1/C=C/c1ccc(OC)cc1,ClCCl,666.0
CCC1=C(C)C2=C(/C=C/c3ccc([N+](=O)[O-])cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,532.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCOC1,524.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,C1COCCO1,524.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,516.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,CC(C)O,518.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,CCO,516.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,520.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,524.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,CO,514.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,CS(C)=O,521.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,527.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,ClC(Cl)Cl,523.0
CCC1=C(C)C2=C(C)c3c(C)c(-c4csc(N5CCOCC5)n4)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,522.0
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCCCC1,522.5
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCOC1,518.4
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1COCCO1,518.6
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,514.8
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC(C)=O,516.0
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC(C)O,518.8
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCC(C)C,520.4
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCC,521.1
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCCCC,521.2
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCCCCCCO,521.8
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCCCCO,521.0
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCCO,520.4
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCO,519.4
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCO,518.9
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCO,517.7
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,516.4
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCOCC,518.8
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,517.1
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN1CCCC1=O,518.2
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CO,516.2
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,522.5
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,520.0
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,515.7
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,OCCO,518.0
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,OCCOc1ccccc1,522.3
CCC1=C(C)C2=C(C)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,c1ccccc1,522.7
CCC1=C(C)C2=C(C)c3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,C1CCCCC1,531.5
CCC1=C(C)C2=C(C)c3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CC(C)=O,517.5
CCC1=C(C)C2=C(C)c3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CCO,522.0
CCC1=C(C)C2=C(C)c3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,521.0
CCC1=C(C)C2=C(C)c3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CO,519.5
CCC1=C(C)C2=C(C)c3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,511.5
CCC1=C(C)C2=C(C)c3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,C1CCCCC1,515.5
CCC1=C(C)C2=C(C)c3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CC(C)=O,502.5
CCC1=C(C)C2=C(C)c3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CCO,505.5
CCC1=C(C)C2=C(C)c3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,506.0
CCC1=C(C)C2=C(C)c3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CO,503.5
CCC1=C(C)C2=C(C)c3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,497.0
CCC1=C(C)C2=C(C)c3cc(I)cn3[B-](F)(F)[N+]2=C1C,C1CCCCC1,517.5
CCC1=C(C)C2=C(C)c3cc(I)cn3[B-](F)(F)[N+]2=C1C,CC(C)=O,502.5
CCC1=C(C)C2=C(C)c3cc(I)cn3[B-](F)(F)[N+]2=C1C,CCO,506.0
CCC1=C(C)C2=C(C)c3cc(I)cn3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,504.5
CCC1=C(C)C2=C(C)c3cc(I)cn3[B-](F)(F)[N+]2=C1C,CO,503.5
CCC1=C(C)C2=C(C)c3cc(I)cn3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,499.5
CCC1=C(C)C2=C(C)c3cccn3[B-](F)(F)[N+]2=C1C,C1CCCCC1,504.0
CCC1=C(C)C2=C(C)c3cccn3[B-](F)(F)[N+]2=C1C,CC(C)=O,495.0
CCC1=C(C)C2=C(C)c3cccn3[B-](F)(F)[N+]2=C1C,CCO,497.0
CCC1=C(C)C2=C(C)c3cccn3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,496.0
CCC1=C(C)C2=C(C)c3cccn3[B-](F)(F)[N+]2=C1C,CO,495.5
CCC1=C(C)C2=C(C)c3cccn3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,492.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCCCC1,532.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCOC1,532.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1COCCO1,533.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,530.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCC,531.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCO,531.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,531.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCOCC,530.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,532.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CS(C)=O,534.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,533.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClC(Cl)(Cl)Cl,534.0
CCC1=C(C)C2=C(c3c(C)cc(C)nc3-c3cccs3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClC(Cl)Cl,535.0
CCC1=C(C)C2=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,528.0
CCC1=C(C)C2=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCC,531.0
CCC1=C(C)C2=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCO,529.0
CCC1=C(C)C2=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,530.0
CCC1=C(C)C2=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,534.0
CCC1=C(C)C2=C(c3c4ccccc4c(-c4ccccc4)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,532.0
CCC1=C(C)C2=C(c3c4ccccc4c(C)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,527.0
CCC1=C(C)C2=C(c3c4ccccc4c(C)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCC,529.0
CCC1=C(C)C2=C(c3c4ccccc4c(C)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCO,528.0
CCC1=C(C)C2=C(c3c4ccccc4c(C)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,530.0
CCC1=C(C)C2=C(c3c4ccccc4c(C)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,532.0
CCC1=C(C)C2=C(c3c4ccccc4c(C)c4ccccc34)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,531.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C(=O)Cl)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCOC1,528.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C(=O)Cl)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,524.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C(=O)Cl)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,529.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C(=O)Cl)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,531.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C(=O)Cl)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClC(Cl)Cl,532.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCOC1,530.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,527.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,535.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,534.0
CCC1=C(C)C2=C(c3cc(C(=O)Cl)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClC(Cl)Cl,534.0
CCC1=C(C)C2=C(c3cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCOC1,534.0
CCC1=C(C)C2=C(c3cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,531.0
CCC1=C(C)C2=C(c3cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,539.0
CCC1=C(C)C2=C(c3cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,537.0
CCC1=C(C)C2=C(c3cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)cc(C4=C5C(C)=C(CC)C(C)=[N+]5[B-](F)(F)n5c(C)c(CC)c(C)c54)c3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClC(Cl)Cl,538.0
CCC1=C(C)C2=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CC#N,523.0
CCC1=C(C)C2=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCCCCC,526.0
CCC1=C(C)C2=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CCO,525.0
CCC1=C(C)C2=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,CN(C)C=O,526.0
CCC1=C(C)C2=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,Cc1ccccc1,529.0
CCC1=C(C)C2=C(c3ccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,527.0
CCC1=C(C)C2=C(c3ccc(-c4ccc(N(c5ccc(-c6ccc(C(=O)O)cc6)cc5)c5ccc(-c6ccc(C7=C8C(C)=C(CC)C(C)=[N+]8[B-](F)(F)n8c(C)c(CC)c(C)c87)s6)cc5)cc4)s3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,540.0
CCC1=C(C)C2=C(c3ccc(C(=O)O)cc3)C3=C(C)C(CC)C(/C=C/c4ccc(OCCOCCOC)cc4)=[N+]3[B-](C#COCCOC)(C#COCCOC)N2C1/C=C/c1ccc(OCCOCCOC)cc1,CC#N,640.0
CCC1=C(C)C2=C(c3ccc(C(=O)O)cc3)C3=C(C)C(CC)C(C)=[N+]3[B-](C#COCCOC)(C#COCCOC)N2C1/C=C/c1ccc(OCCOCCOC)cc1,CC#N,570.0
CCC1=C(C)C2=C(c3ccc(C(=O)O)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,528.0
CCC1=C(C)C2=C(c3ccc(N(c4ccc(C5=C6C(C)=C(CC)C(C)=[N+]6[B-](F)(F)n6c(C)c(CC)c(C)c65)cc4)c4ccc(-c5ccc(C(=O)O)cc5)cc4)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClCCl,526.0
CCC1=C(C)C2=Cc3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,C1CCCCC1,543.5
CCC1=C(C)C2=Cc3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CC(C)=O,528.0
CCC1=C(C)C2=Cc3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CCO,536.0
CCC1=C(C)C2=Cc3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,532.0
CCC1=C(C)C2=Cc3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,CO,531.5
CCC1=C(C)C2=Cc3c(I)c(I)c(I)n3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,523.0
CCC1=C(C)C2=Cc3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,C1CCCCC1,527.5
CCC1=C(C)C2=Cc3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CC(C)=O,509.0
CCC1=C(C)C2=Cc3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CCO,517.5
CCC1=C(C)C2=Cc3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,515.0
CCC1=C(C)C2=Cc3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,CO,513.0
CCC1=C(C)C2=Cc3c(I)c(I)cn3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,501.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](C)(Oc3ccccc3-4)[N+]2=C1C,CC#N,616.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](C)(Oc3ccccc3-4)[N+]2=C1C,CCCCCC,621.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](C)(Oc3ccccc3-4)[N+]2=C1C,Cc1ccccc1,625.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](C)(Oc3ccccc3-4)[N+]2=C1C,ClCCl,622.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3cc[n+](C)cc3)(Oc3ccccc3-4)[N+]2=C1C,CO,621.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3cc[n+](C)cc3)(Oc3ccccc3-4)[N+]2=C1C,CS(C)=O,626.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3cc[n+](C)cc3)(Oc3ccccc3-4)[N+]2=C1C=Cc1ccc(OC)cc1,CO,695.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3cc[n+](C)cc3)(Oc3ccccc3-4)[N+]2=C1C=Cc1ccc(OC)cc1,CS(C)=O,703.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5cc6ccccc6cc5c3)(Oc3ccccc3-4)[N+]2=C1C,CC#N,621.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5cc6ccccc6cc5c3)(Oc3ccccc3-4)[N+]2=C1C,CCCCCC,626.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5cc6ccccc6cc5c3)(Oc3ccccc3-4)[N+]2=C1C,Cc1ccccc1,630.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5cc6ccccc6cc5c3)(Oc3ccccc3-4)[N+]2=C1C,ClCCl,627.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5ccc6cccc7ccc3c5c67)(Oc3ccccc3-4)[N+]2=C1C,CC#N,622.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5ccc6cccc7ccc3c5c67)(Oc3ccccc3-4)[N+]2=C1C,CCCCCC,627.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5ccc6cccc7ccc3c5c67)(Oc3ccccc3-4)[N+]2=C1C,Cc1ccccc1,630.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccc5ccc6cccc7ccc3c5c67)(Oc3ccccc3-4)[N+]2=C1C,ClCCl,628.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccccc3)(Oc3ccccc3-4)[N+]2=C1C,CC#N,621.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccccc3)(Oc3ccccc3-4)[N+]2=C1C,CCCCCC,625.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccccc3)(Oc3ccccc3-4)[N+]2=C1C,Cc1ccccc1,629.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccccc3)(Oc3ccccc3-4)[N+]2=C1C,ClCCl,627.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccncc3)(Oc3ccccc3-4)[N+]2=C1C,CC#N,621.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccncc3)(Oc3ccccc3-4)[N+]2=C1C,CCCCCC,625.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccncc3)(Oc3ccccc3-4)[N+]2=C1C,Cc1ccccc1,629.0
CCC1=C(C)C2=Cc3c4ccccc4c4n3[B-](c3ccncc3)(Oc3ccccc3-4)[N+]2=C1C,ClCCl,627.0
CCC1=C(C)C2=Cc3cc(I)cn3[B-](F)(F)[N+]2=C1C,C1CCCCC1,528.0
CCC1=C(C)C2=Cc3cc(I)cn3[B-](F)(F)[N+]2=C1C,CC(C)=O,509.5
CCC1=C(C)C2=Cc3cc(I)cn3[B-](F)(F)[N+]2=C1C,CCO,514.0
CCC1=C(C)C2=Cc3cc(I)cn3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,513.0
CCC1=C(C)C2=Cc3cc(I)cn3[B-](F)(F)[N+]2=C1C,CO,511.5
CCC1=C(C)C2=Cc3cc(I)cn3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,504.0
CCC1=C(C)C2=Cc3cc4c(cc3B(O)N2C1=O)OCO4,CC#N,383.0
CCC1=C(C)C2=Cc3cc4c(cc3B(O)N2C1=O)OCO4,CO,381.0
CCC1=C(C)C2=Cc3cc4c(cc3B(O)N2C1=O)OCO4,CS(C)=O,384.0
CCC1=C(C)C2=Cc3cc4c(cc3B(O)N2C1=O)OCO4,ClC(Cl)Cl,389.0
CCC1=C(C)C2=Cc3ccccc3B(O)N2C1=O,CC#N,358.0
CCC1=C(C)C2=Cc3ccccc3B(O)N2C1=O,CCCCCC,378.0
CCC1=C(C)C2=Cc3ccccc3B(O)N2C1=O,CO,359.0
CCC1=C(C)C2=Cc3ccccc3B(O)N2C1=O,CS(C)=O,361.0
CCC1=C(C)C2=Cc3ccccc3B(O)N2C1=O,ClC(Cl)Cl,362.0
CCC1=C(C)C2=Cc3cccn3[B-](F)(F)[N+]2=C1C,C1CCCCC1,512.5
CCC1=C(C)C2=Cc3cccn3[B-](F)(F)[N+]2=C1C,CC(C)=O,503.5
CCC1=C(C)C2=Cc3cccn3[B-](F)(F)[N+]2=C1C,CCO,505.5
CCC1=C(C)C2=Cc3cccn3[B-](F)(F)[N+]2=C1C,CCOC(C)=O,505.0
CCC1=C(C)C2=Cc3cccn3[B-](F)(F)[N+]2=C1C,CO,504.5
CCC1=C(C)C2=Cc3cccn3[B-](F)(F)[N+]2=C1C,OCC(F)(F)F,494.5
CCC1=C(C)C2=Cc3cscc3B(O)N2C1=O,CC#N,350.0
CCC1=C(C)C2=Cc3cscc3B(O)N2C1=O,CCCCCC,351.0
CCC1=C(C)C2=Cc3cscc3B(O)N2C1=O,CO,355.0
CCC1=C(C)C2=Cc3cscc3B(O)N2C1=O,CS(C)=O,352.0
CCC1=C(C)C2=Cc3cscc3B(O)N2C1=O,ClC(Cl)Cl,355.0
CCC1=C(C)C2C(c3ccc(-c4ccc(-c5nc6c7ccccc7c7ccccc7c6n5-c5ccc(C(C)(C)C)cc5)cc4)cc3)c3c(C)c(CC)c(C)n3[B-](F)(F)[N+]2=C1C,ClC(Cl)Cl,526.0
CCC1=C(C)c2cc3[nH]c(c(C)c3CC)c(-c3cc(O)cc(O)c3)c3nc(cc4[nH]c(cc1n2)c(CC)c4C)C(CC)=C3C,N#Cc1ccccc1,822.0
CCC1=C(C)c2cc3[nH]c(c(C)c3CC)c(-c3ccc(O)cc3)c3nc(cc4[nH]c(cc1n2)c(CC)c4C)C(CC)=C3C,N#Cc1ccccc1,822.0
CCC1=C(C)c2cc3[nH]c(c(C)c3CC)c(-c3cccc(O)c3)c3nc(cc4[nH]c(cc1n2)c(CC)c4C)C(CC)=C3C,N#Cc1ccccc1,822.0
CCC1=C(C)c2cc3[nH]c(cc4nc(c5c6[nH]c(cc1n2)c(C)c6C(=O)C5)[C@@H](CCC(=O)OC)[C@@H]4C)c(C)c3/C=C(\C)[N+](=O)[O-],ClCCl,676.0
CCC1=C(C)c2cc3[nH]c(cc4nc(c5c6[nH]c(cc1n2)c(C)c6C(=O)C5)[C@@H](CCC(=O)OC)[C@@H]4C)c(C)c3/C=C(\c1ccccc1)[N+](=O)[O-],ClCCl,684.0
CCC1=C(C)c2cc3c(OC)cc(OC)cc3c(=O)n2C1=O,CC#N,433.0
CCC1=C(C)c2cc3c(OC)cc(OC)cc3c(=O)n2C1=O,CO,433.0
CCC1=C(C)c2cc3c(OC)cc(OC)cc3c(=O)n2C1=O,CS(C)=O,434.0
CCC1=C(C)c2cc3c(OC)cc(OC)cc3c(=O)n2C1=O,ClC(Cl)Cl,434.0
CCC1=C(C)c2cc3ccccc3c(=O)n2C1=O,CC#N,369.0
CCC1=C(C)c2cc3ccccc3c(=O)n2C1=O,CCCCCC,366.0
CCC1=C(C)c2cc3ccccc3c(=O)n2C1=O,CO,370.0
CCC1=C(C)c2cc3ccccc3c(=O)n2C1=O,CS(C)=O,373.0
CCC1=C(C)c2cc3ccccc3c(=O)n2C1=O,ClC(Cl)Cl,371.0
CCC1=C(C)c2nc1cc1[nH]c(cc3nc(cc4[nH]c(c(C)c4CC)c2-c2cc(OC)cc(OC)c2)C(C)=C3CCC(=O)OC)c(CCC(=O)OC)c1C,N#Cc1ccccc1,823.0
CCC1=C(C2=C(C3=C(CC)S(=O)(=O)c4cc(-c5ccc(C(C)=O)cc5)ccc43)C(F)(F)C(F)(F)C2(F)F)c2ccc(-c3ccc(C(C)=O)cc3)cc2S1(=O)=O,C1COCCO1,300.0
CCC1=C(C2=C(C3=C(CC)S(=O)(=O)c4cc(-c5ccc(C(C)=O)s5)ccc43)C(F)(F)C(F)(F)C2(F)F)c2ccc(-c3ccc(C(C)=O)s3)cc2S1(=O)=O,C1COCCO1,363.0
CCC1=C(C2=C(C3=C(CC)S(=O)(=O)c4cc(-c5ccc(C)s5)ccc43)C(F)(F)C(F)(F)C2(F)F)c2ccc(-c3ccc(C)s3)cc2S1(=O)=O,C1COCCO1,374.0
CCC1=C(C2=C(C3=C(CC)S(=O)(=O)c4ccccc43)C(F)(F)C(F)(F)C2(F)F)c2ccccc2S1(=O)=O,C1COCCO1,310.0
CCC1=C(CC)C(C)=[N+]2C1=Cc1c(C)c3cc4c(cc3n1[B-]2(F)F)=[N+]1C(=Cc2c(CC)c(CC)c(C)n2[B-]1(F)F)C=4C,ClC(Cl)Cl,692.0
CCC1=C(CC)c2cccc3c2c(cc2nc4ccccc4nc23)O1,ClCCl,501.0
CCC1=CNN(N=Nc2ccc(O)c3ncccc23)S1,CS(C)=O,549.0
CCC1=[N+]2C(=C(c3ccc(C(OC(=O)c4ccccc4)C(=O)NC(C)(C)C)cc3)c3ccc(CC)n3[B-]2(F)F)C=C1,CCOC(C)=O,510.5
CCC1=[N+]2C(=C3c4c(Br)c(Br)c(CC)n4[B-](F)(F)[n+]4c3n(c3ccccc34)[B-]2(F)F)C=C1Br,ClCCl,615.0
CCC1=[N+]2C(=C3c4cc(Br)c(CC)n4[B-](F)(F)[n+]4c3n(c3ccccc34)[B-]2(F)F)C=C1Br,ClCCl,621.0
CCC1=[N+]2C(=C3c4cc(I)c(CC)n4[B-](F)(F)[n+]4c3n(c3ccccc34)[B-]2(F)F)C=C1I,ClCCl,634.0
CCC1=[N+]2C(=C3c4ccc(CC)n4[B-](F)(F)[n+]4c3n(c3cc(OC)ccc34)[B-]2(F)F)C=C1,ClCCl,599.0
CCC1=[N+]2c3c(c4ccc(Oc5c(C)cc(C)cc5C)c5cc6c(Oc7c(C)cc(C)cc7C)ccc7c8cc(CC)n(c8c3c(c54)c67)[B-]2(F)F)=C1,Cc1ccccc1,867.0
CCCBr,CCCCCC,208.0
CCCC(=O)c1c2c(c(C(=O)CCC)c3c1OC(CC(=O)OC)(C(=O)O)O3)OCO2,CC#N,424.0
CCCC(=O)c1c2c(c(C(=O)CCC)c3c1OC(CC(=O)OC)(C(=O)O)O3)OCO2,CCO,445.0
CCCC(=O)c1c2c(c(C(=O)CCC)c3c1OC(CC(=O)OC)(C(=O)O)O3)OCO2,CO,442.0
CCCC(=O)c1c2c(c(C(=O)CCC)c3c1OC(CC(=O)OC)(C(=O)O)O3)OCO2,ClCCl,423.0
CCCC(=O)c1c2c(c(C(=O)CCC)c3c1OC(CC(=O)OC)(C(=O)O)O3)OCO2,O,448.0
CCCC(CC)CN1c2ccccc2Sc2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)ccc21,ClCCl,500.0
CCCC1(CCC)COc2c(/C=C(\C#N)C(=O)O)sc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCC(CCC)(CCC)CO4)c2OC1,C1CCOC1,503.0
CCCC1(CCC)c2cc(-c3ccc(-c4ccc(OC)cc4)o3)ccc2-c2ccc(-c3ccc(-c4ccc(OC)cc4)o3)cc21,C1CCCCC1,410.0
CCCC1(CCC)c2cc(-c3ccc(C(C)(C)C)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(-c5ccc(C(C)(C)C)cc5)ccc3-4)cc21,C1CCCCC1,346.0
CCCC1(CCC)c2cc(-c3ccc(C(C)(C)C)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(-c5ccc6c(c5)C(CCC)(CCC)c5cc(-c7ccc(C(C)(C)C)cc7)ccc5-6)ccc3-4)cc21,C1CCCCC1,362.0
CCCC1(CCC)c2cc(-c3ccc(C(C)(C)C)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(-c5ccc6c(c5)C(CCC)(CCC)c5cc(-c7ccc8c(c7)C(CCC)(CCC)c7cc(-c9ccc(C(C)(C)C)cc9)ccc7-8)ccc5-6)ccc3-4)cc21,C1CCCCC1,366.0
CCCC1(CCC)c2cc(-c3ccc(C(C)(C)CC)cc3)ccc2-c2ccc(-c3ccc(C(C)(C)CC)cc3)cc21,C1CCCCC1,328.0
CCCC1(CCC)c2cc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(-c5ccc6c(c5)C(CCC)(CCC)c5cc(C(C)(C)CC)ccc5-6)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(C(C)(C)CC)ccc3-4)cc21,C1CCCCC1,362.0
CCCC1(CCC)c2cc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(C(C)(C)CC)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(C(C)(C)CC)ccc3-4)cc21,C1CCCCC1,351.0
CCCC1(CCC)c2cc(-c3cccc(C)c3)ccc2-c2ccc(-c3cccc(C)c3)cc21,C1CCCCC1,306.0
CCCC1(CCC)c2cc(-c3cccc(Cc4ccc(/C=C/c5ccccc5)cc4)c3)ccc2-c2ccc(-c3cccc(Cc4ccc(/C=C/c5ccccc5)cc4)c3)cc21,C1CCCCC1,327.0
CCCC1(CCC)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(-c5ccccc5)ccc3-4)cc21,C1CCCCC1,346.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(-c6ccc(/C=C(/C#N)C(=O)O)s6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc21,C1CCOC1,423.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(-c6ccc(/C=C(/C#N)C(=O)O)s6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc21,CC#N,413.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(-c6ccc(/C=C(/C#N)C(=O)O)s6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc21,CN(C)C=O,424.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(-c6ccc(/C=C(/C#N)C(=O)O)s6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc21,Cc1ccccc1,425.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(-c6ccc(/C=C(/C#N)C(=O)O)s6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc21,ClC(Cl)Cl,424.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(-c6ccc(/C=C(/C#N)C(=O)O)s6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc21,ClCCl,429.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,C1CCOC1,405.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,CC#N,417.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,CN(C)C=O,406.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,Cc1ccccc1,423.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,ClC(Cl)Cl,419.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,ClCCl,490.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,C1CCOC1,415.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,CC#N,410.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,CN(C)C=O,408.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,Cc1ccccc1,425.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,ClC(Cl)Cl,425.0
CCCC1(CCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)nc(-c4ccc5c(c4)C(CCC)(CCC)c4cc(N(c6ccccc6)c6ccccc6)ccc4-5)n3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,ClCCl,423.0
CCCC1(CCC)c2cc(C#N)ccc2-c2ccc(C#N)cc21,C1CCCCC1,319.0
CCCC1(CCC)c2cc(C=C(C#Cc3ccccc3)C#Cc3ccccc3)ccc2-c2ccc(C=C(C#Cc3ccccc3)C#Cc3ccccc3)cc21,ClC(Cl)Cl,422.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2cc(N(c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)c4ccc5c(c4)C(CCC)(CCC)c4c6c(c7c(c4-5)C(CCC)(CCC)c4ccccc4-7)Cc4ccccc4-6)ccc2-3)Cc2ccccc2-1,ClCCl,498.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2cc(N(c4ccc(-c5ccc(OC)cc5)cc4)c4ccc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)cc4)ccc2-3)C(CCC)(CCC)c2ccccc2-1,ClCCl,519.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2cc(N(c4ccc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)cc4)c4ccc5c(c4)C(CCC)(CCC)c4c6c(c7c(c4-5)C(CCC)(CCC)c4ccccc4-7)Cc4ccccc4-6)ccc2-3)Cc2ccccc2-1,ClCCl,519.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2cc(N(c4ccc(/C=C/c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)c4ccc5c(c4)C(CCC)(CCC)c4c6c(c7c(c4-5)C(CCC)(CCC)c4ccccc4-7)Cc4ccccc4-6)ccc2-3)Cc2ccccc2-1,ClCCl,540.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2cc(N(c4ccc(OC)cc4)c4ccc(-c5sc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)c6c5OCCO6)cc4)ccc2-3)C(CCC)(CCC)c2ccccc2-1,ClCCl,498.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2cc(N(c4ccc(OC)cc4)c4ccc(-c5sc(C=C(C#N)C(=O)O)c6c5OCCO6)cc4)ccc2-3)C(CCC)(CCC)c2ccccc2-1,ClCCl,472.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2ccc(C(c4ccc(OC)cc4)c4ccc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)cc4)cc2-3)C(CCC)(CCC)c2ccccc2-1,ClCCl,498.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2ccc(N(c4ccc(OC)cc4)c4ccc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)cc4)cc2-3)C(CCC)(CCC)c2ccc(N(c3ccc(OC)cc3)c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)cc3)cc2-1,ClCCl,520.0
CCCC1(CCC)c2ccccc2-c2c1c1c(c3c2C(CCC)(CCC)c2ccccc2-3)Cc2cc(N(c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)cc3)c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)cc3)ccc2-1,ClCCl,501.0
CCCC1(CCC)c2ccccc2-c2cc(N3c4ccc(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)c6nsnc56)cc4C4CCCC43)ccc21,ClCCl,550.0
CCCC1(CCC)c2ccccc2-c2cc(N3c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)cc4C4CCCC43)ccc21,ClCCl,508.0
CCCC1(CCC)c2ccccc2-c2ccc(-c3ccc(C(C)(C)C)cc3)cc21,C1CCCCC1,314.0
CCCC1(CCC)c2ccccc2-c2ccc(-c3ccc(OC)cc3)cc21,C1CCCCC1,315.0
CCCC1(CCC)c2ccccc2-c2ccc(-c3ccc4c(c3)C(CCC)(CCC)c3cc(-c5ccc6c(c5)C(CCC)(CCC)c5ccccc5-6)ccc3-4)cc21,C1CCCCC1,350.0
CCCC1(CCC)c2ccccc2-c2ccc(N(c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)cc3)c3ccc4c(c3)C(CCC)(CCC)c3c5c(c6c(c3-4)C(CCC)(CCC)c3ccccc3-6)C(CCC)(CCC)c3ccccc3-5)cc21,ClCCl,524.0
CCCC1(CCC)c2ccccc2-c2ccc(N3c4ccccc4Sc4ccc(/C=C(/C#N)C(=O)O)cc43)cc21,ClCCl,477.0
CCCC1(CCC)c2ccccc2-c2ccccc21,C1CCCCC1,304.0
CCCC1=C(CCC)c2cccc3c2c(cc2nc4ccccc4nc23)O1,ClCCl,499.0
CCCC1=CC2=C(c3c(C)cc(C)cc3C)c3cc(CCC)c(-c4ccc5ccc6cccc7ccc4c5c67)n3[B-](F)(F)[N+]2=C1c1ccc2ccc3cccc4ccc1c2c34,ClC(Cl)Cl,562.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCC)c1nc(c(NC(=O)CCCC(=O)O)cc3[nH]c2cc3CCC)C(CCC)=C1,ClCCl,636.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCC)c1nc(c(NC(=O)CCCC(=O)OC)cc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,634.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCC)c1nc(c(NC(C)=O)cc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,639.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCC)c1nc(c(O)cc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,677.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCC)c1nc(c(OC(=O)CCCNC(=O)OC(C)(C)C)cc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,645.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCC)c1nc(c(OC(=O)CNC(=O)OC(C)(C)C)cc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,644.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCC)c1nc(c(OC(C)=O)cc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,645.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCO)c1nc(ccc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,637.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(ccc3[nH]c2cc3CCC)C(CCC)=C1,Cc1ccccc1,637.0
CCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(ccc3[nH]c2cc3CCC)C(CCOC)=C1,Cc1ccccc1,638.0
CCCCB1C=Cc2cc3cc4ccccc4cc3cc2N1,ClCCl,427.0
CCCCC,CCCCC,556.0
CCCCC#Cc1cccc2cc(CCCC)c3cc(-c4cc[b-]5c(c4)c(CCCC)cc4cccc(C#CCCCC)[n+]54)cc[b-]3[n+]12,C1CCCCC1,523.0
CCCCC(CC)CC1(CC(CC)CCCC)c2cc(-c3ccc(C=C(C#N)C(=O)O)o3)ccc2-c2cc3c(cc21)-c1ccc(N(c2ccccc2)c2ccccc2)cc1C3(CC(CC)CCCC)CC(CC)CCCC,C1CCOC1,408.0
CCCCC(CC)CC1(CC(CC)CCCC)c2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc2-c2cc3c(cc21)-c1ccc(N(c2ccccc2)c2ccccc2)cc1C3(CC(CC)CCCC)CC(CC)CCCC,C1CCOC1,426.0
CCCCC(CC)CC1(CC(CC)CCCC)c2cc(-c3ccc(C=C(C#N)C(=O)O)s3)sc2-c2sc(-c3cnc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)c4nsnc34)cc21,ClC(Cl)Cl,593.0
CCCCC(CC)CC1(CC(CC)CCCC)c2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)cc3)ccc2-c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)cc3)cc21,C1CCOC1,479.0
CCCCC(CC)CC1(CC(CC)CCCC)c2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)cc3)ccc2-c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)cc3)cc21,C1CCOC1,471.0
CCCCC(CC)CC1(CC(CC)CCCC)c2cc(C=C(C#N)C(=O)O)ccc2-c2cc3c(cc21)-c1ccc(N(c2ccccc2)c2ccccc2)cc1C3(CC(CC)CCCC)CC(CC)CCCC,C1CCOC1,408.0
CCCCC(CC)CN1C(=O)/C(=C2/C(=O)N(CC(CC)CCCC)C3C=C(c4ccc(/C=C(/C#N)C(=O)O)s4)C=CC23)c2ccc(-c3ccc(-c4ccc(N(c5ccc(N6c7ccccc7C=C(OC)c7ccccc76)cc5)c5ccc(N6c7ccccc7C=C(OC)c7ccccc76)cc5)cc4)s3)cc21,ClC(Cl)Cl,616.0
CCCCC(CC)CN1C(=O)/C(=C2/C(=O)N(CC(CC)CCCC)C3C=C(c4ccc(/C=C(/C#N)C(=O)O)s4)C=CC23)c2ccc(-c3ccc(-c4ccc(N5c6ccccc6C=C(OC)c6ccccc65)cc4)s3)cc21,ClC(Cl)Cl,585.0
CCCCC(CC)CN1C(=O)/C(=C2/C(=O)N(CC(CC)CCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc32)c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)cc21,ClCCl,579.0
CCCCC(CC)CN1C(=O)/C(=C2/C(=O)N(CC(CC)CCCC)c3cc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)ccc32)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc21,ClCCl,570.0
CCCCC(CC)CN1C(=O)/C(=c2\s/c(=c3/c(=Cc4ccc5c(c4)C4CCCC4N5c4ccc(C=C(c5ccccc5)c5ccccc5)cc4)sc(=O)n3CC(=O)O)c(=O)n2CC(CC)CCCC)SC1=S,ClC(Cl)Cl,572.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4cc5c(s4)-c4ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc4C5(c4ccc(C)cc4)c4ccc(C)cc4)s3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(C(=O)O)cc2)s1,ClC(Cl)Cl,625.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4cc5c6c7c4cccc7c4cccc7c(-c8ccc(OC)cc8)cc(c6c74)n5CC(CC)CCCC)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)cc1,ClC(Cl)Cl,526.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4cc5c6c7c4cccc7c4cccc7c(OC)cc(c6c74)n5CC(CC)CCCC)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)cc1,ClC(Cl)Cl,527.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)o4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C)cc2)cc1,ClCCl,526.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(Br)cc1,ClCCl,493.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)s4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(Br)cc1,ClCCl,503.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(C5=C6C(C)=CC(C)=[N+]6[B-](F)(F)n6c(C)cc(C)c65)cc4)s3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(C3=C4C(C)=CC(C)=[N+]4[B-](F)(F)n4c(C)cc(C)c43)cc2)s1,Cc1ccccc1,615.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(C5=C6C(C)=CC(C)=[N+]6[B-](F)(F)n6c(C)cc(C)c65)cc4)s3)N(CC(CC)CCCC)C(=O)C2=C1c1cccs1,Cc1ccccc1,580.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cn3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)cn1,C1CCOC1,580.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cn3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cn1,C1CCOC1,564.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4)s3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(C=C(C#N)C(=O)O)cc2)s1,ClCCl,610.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4ccc5c(c4)N(c4ccccc4)C4CCCC54)s3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(C=C(C#N)C(=O)O)o2)cc1,C1CCOC1,596.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)n2C)cc1,C1CCOC1,500.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)n2C)cc1,Cc1ccccc1,500.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)n2C)cc1,ClC(Cl)Cl,500.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)n2C)cc1,ClCCl,500.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc5c6ccccc6c6ccccc6c5n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2C)cc1,C1CCOC1,510.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc5c6ccccc6c6ccccc6c5n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2C)cc1,Cc1ccccc1,510.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc5c6ccccc6c6ccccc6c5n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2C)cc1,ClC(Cl)Cl,510.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(-c4nc5c6ccccc6c6ccccc6c5n4-c4ccccc4)cc3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2C)cc1,ClCCl,510.0
CCCCC(CC)CN1C(=O)C2=C(c3ccc(C#Cc4ccc(C(=O)O)cc4)s3)N(CC(CC)CCCC)C(=O)C2=C1c1ccc(C#CCN(C)C)s1,C1CCOC1,602.0
CCCCC(CC)CN1C(=O)C2C(=C1c1ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc1)C(=O)N(CC(CC)CCCC)C2c1ccc(N(c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)cc1,ClCCl,535.0
CCCCC(CC)CN1C(=O)c2c(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)c(F)c4)s3)sc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5CC(CC)CCCC)s3)c2C1=O,C1CCOC1,462.0
CCCCC(CC)CN1C(=O)c2c(-c3ccc(C=C(C#N)C(=O)O)s3)sc(-c3ccc(-c4cc5c6c(c4)CCCN6CCC5)s3)c2C1=O,C1CCOC1,506.0
CCCCC(CC)CN1C(=O)c2c(-c3ccc4c(c3)c3ccccc3n4-c3ccc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc3)sc(-c3ccc(/C=C(\C#N)C(=O)O)o3)c2C1=O,C1CCOC1,402.0
CCCCC(CC)CN1C(=O)c2c(-c3ccc4c(c3)c3ccccc3n4-c3ccc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc3)sc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2C1=O,C1CCOC1,427.0
CCCCC(CC)CN1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(OC)cc5)cc5c6c(cc(Oc7ccc(OC)cc7)c(c7c(Oc8ccc(C(C)(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)N(c1c(C(C)C)cccc1C(C)C)C5=O,Cc1ccccc1,581.0
CCCCC(CC)CN1C(=O)c2cc(Oc3ccc(C(C)(C)CC(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)CC(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)CC(C)(C)C)cc7)c(c7c(Oc8ccc(C(C)(C)CC(C)(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)OC5=O,ClCCl,590.0
CCCCC(CC)CN1C(=O)c2cc(Oc3ccc(OC)cc3)c3c4c(Cl)cc5c6c(cc(Cl)c(c7c(Oc8ccc(OC)cc8)cc(c2c37)C1=O)c64)C(=O)N(c1c(C(C)C)cccc1C(C)C)C5=O,Cc1ccccc1,565.0
CCCCC(CC)CN1C(=O)c2cc(Oc3ccc(OC)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)C)cc7)c(c7c(Oc8ccc(OC)cc8)cc(c2c37)C1=O)c64)C(=O)N(c1c(C(C)C)cccc1C(C)C)C5=O,Cc1ccccc1,581.0
CCCCC(CC)CN1C(=O)c2ccc3c4c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc5c6c(cc(-c7ccc(-n8c9ccccc9c9ccccc98)cc7)c(c7ccc(c2c37)C1=O)c64)C(=O)N(CC(CC)CCCC)C5=O,ClC(Cl)Cl,567.0
CCCCC(CC)CN1C(=O)c2ccc3c4c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc5c6c(cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)c(c7ccc(c2c37)C1=O)c64)C(=O)N(CC(CC)CCCC)C5=O,ClC(Cl)Cl,563.0
CCCCC(CC)CN1C(=O)c2ccc3c4c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc5c6c(ccc(c7c(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc(c2c37)C1=O)c64)C(=O)N(CC(CC)CCCC)C5=O,ClC(Cl)Cl,609.0
CCCCC(CC)CN1C(=O)c2ccc3c4c(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc5c6c(cc(-c7ccc8c9ccccc9n(-c9ccccc9)c8c7)c(c7ccc(c2c37)C1=O)c64)C(=O)N(CC(CC)CCCC)C5=O,ClC(Cl)Cl,551.0
CCCCC(CC)CN1C(=O)c2ccc3c4c(-c5ccc6c7ccccc7n(-c7ccccc7)c6c5)cc5c6c(ccc(c7c(-c8ccc9c%10ccccc%10n(-c%10ccccc%10)c9c8)cc(c2c37)C1=O)c64)C(=O)N(CC(CC)CCCC)C5=O,ClC(Cl)Cl,561.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)cc4)ccc(c23)C1=O,C1CCCCC1,444.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)cc4)ccc(c23)C1=O,C1CCOC1,447.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)cc4)ccc(c23)C1=O,CC#N,454.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)cc4)ccc(c23)C1=O,Cc1ccccc1,446.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)c5ccc(C#Cc6ccc7c8c(cccc68)C(=O)N(CC(CC)CCCC)C7=O)cc5)cc4)ccc(c23)C1=O,ClC(Cl)Cl,453.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(c23)C1=O,C1CCCCC1,422.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(c23)C1=O,C1CCOC1,434.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(c23)C1=O,CC#N,433.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(c23)C1=O,Cc1ccccc1,438.0
CCCCC(CC)CN1C(=O)c2cccc3c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(c23)C1=O,ClC(Cl)Cl,450.0
CCCCC(CC)CN1c2ccc(-c3ccc4c(c3)c3nc5ccccc5nc3n4CC(CC)CCCC)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,484.0
CCCCC(CC)CN1c2ccc(-c3ccc4c5nc6ccccc6nc5n(CC(CC)CCCC)c4c3)cc2Sc2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc21,ClCCl,484.0
CCCCC(CC)CN1c2ccc(/C=C(\C#N)C(=O)O)cc2N(CC(CC)CCCC)c2ccc(/C=C(\C#N)C(=O)O)cc21,C1CCOC1,508.0
CCCCC(CC)CN1c2ccc(/C=C/C(=O)O)cc2Sc2cc(/C=C/C3=CC(=C(C#N)C#N)C=C(/C=C/c4ccc5c(c4)Sc4cc(/C=C/C(=O)O)ccc4N5CC(CC)CCCC)O3)ccc21,CN(C)C=O,478.0
CCCCC(CC)CN1c2ccc(/C=C/C(=O)O)cc2Sc2cc(/C=C/C3=CC(=C4C(=O)N(CC)C(=S)N(CC)C4=O)C=C(/C=C/c4ccc5c(c4)Sc4cc(/C=C/C(=O)O)ccc4N5CC(CC)CCCC)O3)ccc21,CN(C)C=O,520.0
CCCCC(CC)CN1c2ccc(/C=C/C(=O)O)cc2Sc2cc(/C=C/C3=CC(=C4C(=O)c5ccccc5C4=C(C#N)C#N)C=C(/C=C/c4ccc5c(c4)Sc4cc(/C=C/C(=O)O)ccc4N5CC(CC)CCCC)O3)ccc21,CN(C)C=O,581.0
CCCCC(CC)CN1c2ccc(/C=C\C3=CC(=C(C#N)C#N)C=C(/C=C/c4ccc5c(c4)Sc4cc(/C=N\C(=O)O)ccc4N5CC(CC)CCCC)O3)cc2Sc2cc(/C=C/C(=O)O)ccc21,CN(C)C=O,478.0
CCCCC(CC)CN1c2ccc(/C=C\C3=CC(=C4C(=O)N(CC)C(=S)N(CC)C4=O)C=C(/C=C/c4ccc5c(c4)Sc4cc(/C=C\C(=O)O)ccc4N5CC(CC)CCCC)O3)cc2Sc2cc(/C=C/C(=O)O)ccc21,CN(C)C=O,520.0
CCCCC(CC)CN1c2ccccc2Sc2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)s3)ccc21,ClCCl,500.0
CCCCC(CC)CN1c2ccccc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,467.0
CCCCC(CC)CN1c2ccccc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,C1CCOC1,436.0
CCCCC(CC)CN1c2ccccc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,CCO,414.0
CCCCC(CC)CN1c2ccccc2Sc2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc21,ClCCl,467.0
CCCCC(CC)COC(=O)/C=C/c1c(OC)ccc(OC)c1OC,CCCCCC,320.0
CCCCC(CC)COC(=O)/C=C/c1c(OC)ccc(OC)c1OC,CO,325.0
CCCCC(CC)COC(=O)/C=C/c1ccc(OC)c(OC)c1OC,CCCCCC,290.0
CCCCC(CC)COC(=O)/C=C/c1ccc(OC)c(OC)c1OC,CO,309.0
CCCCC(CC)COC(=O)/C=C\c1ccc(OC)c(OC)c1OC,CCCCCC,329.0
CCCCC(CC)COC(=O)/C=C\c1ccc(OC)c(OC)c1OC,CO,303.0
CCCCC(CC)COC(=O)/C=C\c1ccccc1OC,CCCCCC,298.0
CCCCC(CC)COC(=O)/C=C\c1ccccc1OC,CO,305.0
CCCCC(CC)CO[N+](=O)[O-],CO,218.0
CCCCC(CC)CO[N+](=O)[O-],O,198.0
CCCCC(CC)COc1c(OCC(CC)CCCC)c2c3sc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)c5nc(-c6ccc(C)s6)c(-c6csc(C)c6)nc45)cc3sc2c2sc3cc(/C=C(/C#N)C(=O)O)sc3c12,C1CCOC1,481.0
CCCCC(CC)COc1c(OCC(CC)CCCC)c2c3sc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)c5nsnc45)cc3sc2c2sc3cc(/C=C(/C#N)C(=O)O)sc3c12,C1CCOC1,494.0
CCCCC(CC)COc1c(OCC(CC)CCCC)c2c3sc(-c4ccc5c(c4)c4ccc(-c6cc7sc8c9sc%10cc(/C=C(/C#N)C(=O)O)sc%10c9c(OCC(CC)CCCC)c(OCC(CC)CCCC)c8c7s6)cc4n5CC(CC)CCCC)cc3sc2c2sc3cc(/C=C(/C#N)C(=O)O)sc3c12,C1CCOC1,467.0
CCCCC(CC)COc1c(OCC(CC)CCCC)c2c3sc(-c4ccc5c(c4)c4ccccc4n5CC(CC)CCCC)cc3sc2c2sc3cc(/C=C(/C#N)C(=O)O)sc3c12,C1CCOC1,464.0
CCCCC(CC)COc1cc(OCC(CC)CCCC)c2c#cc3ccc4c(c3)c3cc(c#cc5cc(c#cc6ccc7c(c6)c6cc(c#cc1c2)ccc6n7CC(CC)CCCC)c(C(CCCC)OCCC)cc5C(CCCC)OCCC)ccc3n4CC(CC)CCCC,ClCCl,340.0
CCCCC(CC)COc1cc(OCC(CC)CCCC)c2c#cc3ccc4oc5ccc(c#cc6cc(c#cc7ccc8oc9ccc(c#cc1c2)cc9c8c7)c(C(CCCC)OCCC)cc6C(CCCC)OCCC)cc5c4c3,ClCCl,328.0
CCCCC(CC)COc1cc(OCC(CC)CCCC)c2c#cc3ccc4sc5ccc(c#cc6cc(c#cc7ccc8sc9ccc(c#cc1c2)cc9c8c7)c(C(CCCC)OCCC)cc6C(CCCC)OCCC)cc5c4c3,ClCCl,333.0
CCCCC(CC)COc1cc(OCCC(CC)CCC)cc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(-c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)cc7)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)cc4C5(CC(CC)CCCC)CC(CC)CCCC)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c1,ClCCl,545.0
CCCCC(CC)COc1cc(OCCC(CC)CCC)cc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)s4)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c1,ClCCl,491.0
CCCCC(CC)COc1cc(OCCC(CC)CCC)cc(-c2ccc(N(c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)c3ccc(-c4sc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)c5c4OCCO5)cc3)cc2)c1,ClCCl,515.0
CCCCC(CC)COc1cc2c(cc1OCC(CC)CCCC)c1c3sc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)c5nsnc45)cc3sc1c1sc3cc(/C=C(\C#N)C(=O)O)sc3c21,C1CCOC1,513.0
CCCCC(CC)COc1cc2c(cc1OCC(CC)CCCC)c1sc(-c3ccc4c(c3)c3ccccc3n4CCCC)cc1c1cc(C=C(C#N)C(=O)O)sc12,C1CCOC1,491.0
CCCCC(CC)COc1ccc(-c2c3cccc4c(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc5c(-c6ccc(OCC(CC)CCCC)cc6)c6cccc7c(-c8ccc(N(c9ccc(C)cc9)c9ccc(C)cc9)cc8)cc2c(c76)c5c43)cc1,C1CCOC1,464.0
CCCCC(CC)COc1ccc(-c2cc3c(s2)c2c4nsnc4c4c5sc(C#Cc6ccc(-c7ccc(C(=O)O)cc7)c7nsnc67)cc5n(CC(CC)CCCC)c4c2n3CC(CC)CCCC)cc1,ClCCl,512.0
CCCCC(CC)COc1ccc(-c2cc3c(s2)c2c4nsnc4c4c5sc(C#Cc6ccc(C(=O)O)cc6)cc5n(CC(CC)CCCC)c4c2n3CC(CC)CCCC)cc1,ClCCl,476.0
CCCCC(CC)COc1ccc(-c2cc3c4c5c2cccc5c2cccc5c(-c6ccc(-c7ccc(-c8ccc(/C=C(\C#N)C(=O)O)s8)c8nc(-c9ccccc9)c(-c9ccccc9)nc78)s6)cc(c4c52)n3CC(CC)CCCC)cc1,C1CCOC1,525.0
CCCCC(CC)COc1ccc(-c2cc3c4c5c2cccc5c2cccc5c(-c6ccc(-c7ccc(-c8ccc(/C=c9/sc(=C(C#N)C#N)[nH]c9=O)s8)c8nc(-c9ccccc9)c(-c9ccccc9)nc78)s6)cc(c4c52)n3CC(CC)CCCC)cc1,C1CCOC1,516.0
CCCCC(CC)COc1ccc(-c2cc3ccc(C=C(C#N)C(=O)O)c4cc(-c5ccc(OCC(CC)CCCC)cc5)c5ccc2n5c34)cc1,ClC(Cl)Cl,530.0
CCCCC(CC)COc1ccc(-c2cc3ccc(C=Cc4ccc(C(=O)O)s4)c4cc(-c5ccc(OCC(CC)CCCC)cc5)c5ccc2n5c34)cc1,ClC(Cl)Cl,490.0
CCCCC(CC)COc1ccc(-c2ccc(C(=Cc3ccc(N4c5ccc(-c6cnc(-c7cc8c(s7)-c7sc(/C=C(\C#N)C(=O)O)cc7C8(CC(CC)CCCC)CC(CC)CCCC)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c(OCC(CC)CCCC)c1,ClCCl,562.0
CCCCC(CC)COc1ccc(-c2ccc(C(=Cc3ccc(N4c5ccc(-c6cnc(-c7sc(/C=C(\C#N)C(=O)O)c8c7OCCO8)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c(OCC(CC)CCCC)c1,ClCCl,561.0
CCCCC(CC)COc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(-c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)s7)c7nsnc67)cc4C5(CC(CC)CCCC)CC(CC)CCCC)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c(OCC(CC)CCCC)c1,ClCCl,618.0
CCCCC(CC)COc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(-c6ccc(-c7ccc(C=C(C#N)C(=O)O)cc7)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)cc4C5(CCC(CC)CCC)CC(CC)CCCC)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c(OCC(CC)CCCC)c1,ClCCl,545.0
CCCCC(CC)COc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(/C=C(\C#N)C(=O)O)cc4C5(CC(CC)CCCC)CC(CC)CCCC)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c(OCC(CC)CCCC)c1,ClCCl,543.0
CCCCC(CC)COc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)cc6)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)s4)cc3)c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)cc2)c(OCC(CC)CCCC)c1,ClCCl,491.0
CCCCC(CC)COc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCC(CC)CCCC)cc4OCC(CC)CCCC)cc3)c3ccc(-c4ccc(-c5cc6c(s5)-c5sc(-c7ccc(/C=C(\C#N)C(=O)O)cc7)cc5C6(CC(CC)CCCC)CC(CC)CCCC)c5nsnc45)cc3)cc2)c(OCC(CC)CCCC)c1,CC#N,441.0
CCCCC(CC)COc1ccc(-n2c3ccccc3c3cc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)ccc32)cc1,C1CCOC1,476.0
CCCCC(CC)COc1ccc(-n2c3ccccc3c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)cc32)cc1,C1CCOC1,461.0
CCCCC(CC)COc1ccc(N(c2ccc(OCC(CC)CCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(C=C(C#N)c5ccc(C(=O)O)cc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,Clc1ccccc1,521.0
CCCCC(CC)COc1ccc(N(c2ccc(OCC(CC)CCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)s5)c5nsnc45)s3)cc2)cc1,C1CCOC1,530.0
CCCCC(CC)COc1ccc(N(c2ccc(OCC(CC)CCCC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)o4)c4nc5c(nc34)-c3ccccc3C3(c4ccccc4-c4ccccc43)c3ccccc3-5)cc2)cc1,ClCCl,531.0
CCCCC(CC)COc1ccc(N(c2ccc(OCC(CC)CCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)s5)c5c4C(=O)N(CC(CC)CCCC)C5=O)s3)cc2)cc1,C1CCOC1,481.0
CCCCC(CC)COc1ccc2nc(-c3ccc(-c4ccc(N(C)C)cc4)s3)sc2c1,ClCCl,402.0
CCCCC(CC)COc1ccc2nc(-c3ccc(-c4ccc(OC)cc4)s3)sc2c1,ClCCl,365.0
CCCCC(CC)COc1ccc2nc(-c3ccc(-c4ccccc4)s3)sc2c1,ClCCl,368.0
CCCCC(CC)COc1ccc2nc(-c3ccc(-c4cccs4)s3)sc2c1,ClCCl,382.0
CCCCC(CC)COc1ccccc1/C1=C2\C=CC(=N2)/C(c2ccccc2OCC(CC)CCCC)=c2/cc/c3n2[Zn]n2c1ccc2/C(c1ccccc1OCC(CC)CCCC)=C1\N=C(C=C1C#Cc1ccc(/C=C(\C#N)C(=O)O)cc1)/C=3c1ccccc1OCC(CC)CCCC,C1CCOC1,605.0
CCCCC(CC)C[Ge]1(CC(CC)CCCC)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc2-c2sc(-c3cnc(-c4ccc(C(=O)O)s4)c4nsnc34)cc21,C1CCOC1,583.0
CCCCC(CC)C[Si]1(CC(CC)CCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)c4nsnc34)cc21,ClCCl,562.0
CCCCC(CC)C[Si]1(CC(CC)CCCC)c2cc(C=C(C#N)C(=O)O)sc2-c2cc(-c3ccc(N(c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)sc21,C1CCOC1,490.0
CCCCC(CC)Cc1cc(-c2ccc(-c3cc(CC(CC)CCCC)c(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)c3nsnc23)sc1-c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)s1,ClCCl,529.0
CCCCC(CC)Cc1cc(-c2sc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3CC(CC)CCCC)cc2CC(CC)CCCC)sc1/C=C(\C#N)C(=O)O,C1CCOC1,454.0
CCCCC(CC)Cc1cc(-c2sc(-c3sc(-c4ccc5c(c4)c4ccccc4n5CC)cc3CC(CC)CCCC)cc2CC(CC)CCCC)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,470.0
CCCCC(CC)Cc1cc(-c2sc(-c3sc(/C=C(/C#N)C(=O)O)cc3CC(CC)CCCC)cc2CC(CC)CCCC)sc1-c1ccc2c(c1)c1ccccc1n2CC,ClC(Cl)Cl,451.0
CCCCC(CC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1sc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2CC(CC)CCCC)c2c1NC1=C(N2)c2cccc3cccc1c23,Cc1ccccc1,625.0
CCCCC(CC)Cc1cc(C)sc1-c1nc2c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)sc3c3sc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)cc3c2nc1-c1sc(C)cc1CC(CC)CCCC,C1CCOC1,414.0
CCCCC(CC)Cc1cc(C)sc1-c1nc2c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)sc3c3sc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3c2nc1-c1sc(C)cc1CC(CC)CCCC,C1CCOC1,396.0
CCCCC(CC)Cc1cc(C)sc1-c1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)cc3c2nc1-c1sc(C)cc1CC(CC)CCCC,C1CCOC1,418.0
CCCCC(CC)Cc1cc(C)sc1-c1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c2nc1-c1sc(C)cc1CC(CC)CCCC,C1CCOC1,370.0
CCCCC(CC)Cc1cc(C=C(C#N)C(=O)O)sc1-c1sc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2CC(CC)CCCC)c2nccnc12,ClC(Cl)Cl,592.0
CCCCC(CC)Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4sc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)s5)c5c4C(=O)N(CC(CC)CCCC)C5=O)s3)cc2)cc1,C1CCOC1,475.0
CCCCC(CC)Cn1c(C=C(C#N)C(=O)O)ccc1/C=N/N(c1ccccc1)c1ccccc1,C1CCOC1,469.0
CCCCC(CC)Cn1c2c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3sc2c2sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3c21,C1CCOC1,471.0
CCCCC(CC)Cn1c2c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3sc2c2sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3c21,C1CCOC1,466.0
CCCCC(CC)Cn1c2c3ccc(-c4ccc5c6ccccc6n(CC)c5c4)cc3sc2c2sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3c21,C1CCOC1,473.0
CCCCC(CC)Cn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2nc3ccccc3nc21,ClCCl,439.0
CCCCC(CC)Cn1c2cc(-c3ccc(/C=c4\sc(=C(C#N)C#N)[nH]c4=O)o3)ccc2c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc21,ClCCl,476.0
CCCCC(CC)Cn1c2cc(-c3ccc(/C=c4\sc(=C(C#N)C#N)[nH]c4=O)s3)ccc2c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc21,ClCCl,462.0
CCCCC(CC)Cn1c2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc2c2nc3ccccc3nc21,ClCCl,439.0
CCCCC(CC)Cn1c2cc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)c3cccc4c5cccc6c(-c7ccc(-c8ccc(/C=C(\C#N)C(=O)O)s8)s7)cc1c(c65)c2c34,ClCCl,472.0
CCCCC(CC)Cn1c2cc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)c3cccc4c5cccc6c(-c7ccc(C=C(C#N)C(=O)O)s7)cc1c(c65)c2c34,ClCCl,472.0
CCCCC(CC)Cn1c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)cc2c2cc(C#N)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,369.0
CCCCC(CC)Cn1c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3cccc4c5cccc6c(-c7ccc(C=C(C#N)C(=O)O)s7)cc1c(c65)c2c34,ClCCl,472.0
CCCCC(CC)Cn1c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2c2cc3c(cc21)c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1n3CC(CC)CCCC,ClCCl,462.0
CCCCC(CC)Cn1c2cc(/C=C(/C#N)C(=O)O)sc2c2sc3c(sc4c5sc(/C=C(\C#N)C(=O)O)cc5n(CC(CC)CCCC)c43)c21,C1CCOC1,549.0
CCCCC(CC)Cn1c2cc(C#N)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)cc21,ClCCl,420.0
CCCCC(CC)Cn1c2cc(C#N)ccc2c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)cc21,ClCCl,398.0
CCCCC(CC)Cn1c2cc(C#N)ccc2c2ccc(C#Cc3cc(C#Cc4ccc5c6ccc(C#N)cc6n(CC(CC)CCCC)c5c4)c4ccc5c(C#Cc6ccc7c8ccc(C#N)cc8n(CC(CC)CCCC)c7c6)cc(C#Cc6ccc7c8ccc(C#N)cc8n(CC(CC)CCCC)c7c6)c6ccc3c4c65)cc21,ClCCl,467.0
CCCCC(CC)Cn1c2cc(C#N)ccc2c2ccc(C#Cc3ccc4ccc5c(C#Cc6ccc7c8ccc(C#N)cc8n(CC(CC)CCCC)c7c6)cc(C#Cc6ccc7c8ccc(C#N)cc8n(CC(CC)CCCC)c7c6)c6ccc3c4c56)cc21,ClCCl,447.0
CCCCC(CC)Cn1c2cc(C#N)ccc2c2ccc(C#Cc3ccc4ccc5c(C#Cc6ccc7c8ccc(C#N)cc8n(CC(CC)CCCC)c7c6)ccc6ccc3c4c65)cc21,ClCCl,385.0
CCCCC(CC)Cn1c2cc(C#N)ccc2c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,ClCCl,410.0
CCCCC(CC)Cn1c2cc(C=C(C#N)C(=O)O)c3cccc4c5cccc6c(-c7ccc(N(c8ccc(OC)cc8)c8ccc(OC)cc8)cc7)cc1c(c65)c2c34,ClCCl,512.0
CCCCC(CC)Cn1c2cc(C=C(C#N)C(=O)O)sc2c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClC(Cl)Cl,479.0
CCCCC(CC)Cn1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2c2cc3c4cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc4n(CC(CC)CCCC)c3cc21,ClCCl,467.0
CCCCC(CC)Cn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc3c(cc21)c1cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)ccc1n3CC(CC)CCCC,ClCCl,500.0
CCCCC(CC)Cn1c2ccc(-c3ccc4c(c3)C(CCCC)(CCCC)c3cc(-c5ccc(/C=C(/C#N)C(=O)O)cc5)ccc3-4)cc2c2ccc3ccccc3c21,C1CCOC1,389.0
CCCCC(CC)Cn1c2ccc(-c3ccc4c(c3)C(CCCC)(CCCC)c3cc(-c5ccc(/C=C(/C#N)C(=O)O)o5)ccc3-4)cc2c2ccc3ccccc3c21,C1CCOC1,436.0
CCCCC(CC)Cn1c2ccc(-c3ccc4c(c3)C(CCCC)(CCCC)c3cc(-c5ccc(/C=C(/C#N)C(=O)O)s5)ccc3-4)cc2c2ccc3ccccc3c21,C1CCOC1,433.0
CCCCC(CC)Cn1c2ccc(-c3ccc4c(c3)c3nc5ccccc5nc3n4CC(CC)CCCC)cc2c2cc(-c3ccc(/C=C(/C#N)C(=O)O)o3)ccc21,ClCCl,455.0
CCCCC(CC)Cn1c2ccc(-c3ccc4c(c3)c3nc5ccccc5nc3n4CC(CC)CCCC)cc2c2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,ClCCl,465.0
CCCCC(CC)Cn1c2ccc(-n3c4ccccc4c4ccccc43)cc2c2cc(-n3c4ccccc4c4ccccc43)ccc21,C1CCOC1,367.0
CCCCC(CC)Cn1c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2c2c(-c3ccc(Br)cc3)c3c(c(-c4ccc(Br)cc4)c21)c1cc(C(=C(C#N)C#N)c2ccccc2)ccc1n3CC(CC)CCCC,C1CCOC1,460.0
CCCCC(CC)Cn1c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2c2c(-c3ccc(Br)cc3)c3c(c(-c4ccc(Br)cc4)c21)c1cc(C(=C(C#N)C#N)c2ccccc2)ccc1n3CC(CC)CCCC,CC#N,462.0
CCCCC(CC)Cn1c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2c2c(-c3ccc(Br)cc3)c3c(c(-c4ccc(Br)cc4)c21)c1cc(C(=C(C#N)C#N)c2ccccc2)ccc1n3CC(CC)CCCC,CCO,464.0
CCCCC(CC)Cn1c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2c2c(-c3ccc(Br)cc3)c3c(c(-c4ccc(Br)cc4)c21)c1cc(C(=C(C#N)C#N)c2ccccc2)ccc1n3CC(CC)CCCC,CCOC(C)=O,457.0
CCCCC(CC)Cn1c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2c2c(-c3ccc(Br)cc3)c3c(c(-c4ccc(Br)cc4)c21)c1cc(C(=C(C#N)C#N)c2ccccc2)ccc1n3CC(CC)CCCC,CN(C)C=O,467.0
CCCCC(CC)Cn1c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2c2c(-c3ccc(Br)cc3)c3c(c(-c4ccc(Br)cc4)c21)c1cc(C(=C(C#N)C#N)c2ccccc2)ccc1n3CC(CC)CCCC,ClCCl,471.0
CCCCC(CC)Cn1c2ccc(C(=C(C#N)C#N)c3ccccc3)cc2c2c(-c3ccc(Br)cc3)c3c(c(-c4ccc(Br)cc4)c21)c1cc(C(=C(C#N)C#N)c2ccccc2)ccc1n3CC(CC)CCCC,c1ccccc1,458.0
CCCCC(CC)Cn1c2ccccc2c2c(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3)c3c(c(-c4ccc(-c5cc(OC)c(OC)c(OC)c5)cc4)c21)c1ccccc1n3CC(CC)CCCC,ClCCl,419.0
CCCCC(CC)Cn1c2ccccc2c2c(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3c(c(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)c21)c1ccccc1n3CC(CC)CCCC,CN(C)C=O,473.0
CCCCC(CC)Cn1c2ccccc2c2c(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3c(c(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)c21)c1ccccc1n3CC(CC)CCCC,ClCCl,419.0
CCCCC(CC)Cn1c2ccccc2c2cc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)o4)c4nc5c(nc34)-c3ccccc3C3(c4ccccc4-c4ccccc43)c3ccccc3-5)ccc21,ClCCl,490.0
CCCCC(CC)Cn1c2ccccc2c2cc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)c4nsnc34)ccc21,C1CCOC1,484.0
CCCCC(CC)Cn1c2ccccc2c2cc(-c3ccc4c(c3)-c3cc(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)ccc3S4(=O)=O)ccc21,Cc1ccccc1,340.0
CCCCC(CC)Cn1c2ccccc2c2cc(-c3ccc4c(c3)-c3cc(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)ccc3S4(=O)=O)ccc21,ClC(Cl)Cl,355.0
CCCCC(CC)Cn1c2ccccc2c2cc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)ccc3-4)ccc21,Cc1ccccc1,379.0
CCCCC(CC)Cn1c2ccccc2c2cc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)ccc3-4)ccc21,ClC(Cl)Cl,382.0
CCCCC(CC)Cn1c2ccccc2c2cc(-c3sc4c(sc5c6sc7c(C(CC)CCCC)c(/C=C(\C#N)C(=O)O)sc7c6c6nccnc6c45)c3C(CC)CCCC)ccc21,C1CCOC1,586.0
CCCCC(CC)Cn1c2ccccc2c2ccc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5ccc6c7ccccc7n(CC(CC)CCCC)c6c5)ccc3-4)cc21,Cc1ccccc1,370.0
CCCCC(CC)Cn1c2ccccc2c2ccc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5ccc6c7ccccc7n(CC(CC)CCCC)c6c5)ccc3-4)cc21,ClC(Cl)Cl,371.0
CCCCC(CC)Cn1c2ccccc2c2ccc(-c3ccc4c5ccccc5n(CC(CC)CCCC)c4c3)cc21,C1CCOC1,352.0
CCCCC(CC)Cn1c2ccccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,C1CCOC1,339.0
CCCCC(CC)Cn1c2ccccc2c2ccc3c4cc(-c5cc6sc(-c7ccc(/C=C(\C#N)C(=O)O)s7)cc6s5)ccc4n(CC(CC)CCCC)c3c21,ClC(Cl)Cl,479.0
CCCCC(CC)Cn1c2ccccc2c2ccc3c4cc(-c5ccc(-c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)s7)s6)s5)ccc4n(CC(CC)CCCC)c3c21,ClC(Cl)Cl,483.0
CCCCC(CC)Cn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc(-c3ccc(C=C(C#N)C(=O)O)o3)c2n1,ClCCl,450.0
CCCCC(CC)Cn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc(-c3ccc(C=C(C#N)C(=O)O)s3)c2n1,ClCCl,449.0
CCCCC(CC)Cn1nc2c(/C=C(\C#N)C(=O)O)ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2n1,C1CCOC1,430.0
CCCCC(CC)Cn1nc2c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)sc3c3sc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3c2n1,C1CCOC1,468.0
CCCCC(CC)Cn1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c2n1,C1CCOC1,434.0
CCCCC(CC)Cn1nc2c3cc(C=C(C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c2n1,C1CCOC1,434.0
CCCCC1(CCCC)C(C=C2C(=O)C(c3ccc4c(c3)C3CCCC3N4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)=C2[O-])=[N+](CCC(=O)O)c2ccccc21,CS(C)=O,643.0
CCCCC1(CCCC)C(C=C2C(=O)C(c3ccc4c(c3)C3CCCC3N4c3ccc4c(c3)C(C)(C)c3ccccc3-4)=C2[O-])=[N+](CCC(=O)O)c2ccccc21,CS(C)=O,643.0
CCCCC1(CCCC)CC(=CC=C(C)c2ccc(C=C(C#N)C(=O)O)s2)c2ccc(N(c3ccc4c(c3)C(CCCC)(CCCC)c3cc(-c5ccc(C=C(C#N)C(=O)O)s5)ccc3-4)c3ccc4c(c3)c3ccccc3n4CC)cc21,C1CCOC1,492.0
CCCCC1(CCCC)c2cc(-c3cc4c(s3)c3sc(/C=C(/C#N)C(=O)O)cc3n4-c3ccc4c(c3)C(CCCC)(CCCC)c3ccccc3-4)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,483.0
CCCCC1(CCCC)c2cc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc4c(c3)C(CCCC)(CCCC)c3ccccc3-4)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,483.0
CCCCC1(CCCC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N3c4ccccc4Sc4cc(C=C5c6ccccc6-c6ccccc65)ccc43)cc21,ClCCl,453.0
CCCCC1(CCCC)c2cc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccc4c(c3)C(CCCC)(CCCC)c3cc(-c5ccc(-c6ccc(CC=C(C#N)C(=O)O)s6)s5)ccc3-4)c3ccc4c(c3)c3ccccc3n4CC)cc21,C1CCOC1,506.0
CCCCC1(CCCC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N3c4ccccc4Sc4cc(C=C5c6ccccc6-c6ccccc65)ccc43)cc21,ClCCl,427.0
CCCCC1(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc21,CCO,451.0
CCCCC1(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2-c2ccc(N(c3ccc(OC)cc3)c3ccc4c(c3)C(CCCC)(CCCC)c3cc(/C=C(\C#N)C(=O)O)ccc3-4)cc21,ClCCCl,500.0
CCCCC1(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2-c2ccc(N(c3ccc(OCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc3)c3ccc4c(c3)C(CCCC)(CCCC)c3cc(/C=C(\C#N)C(=O)O)ccc3-4)cc21,ClCCCl,495.0
CCCCC1(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2-c2ccc(N(c3ccc(OCCOC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)cc3)c3ccc(OCCOC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)cc3)cc21,CCO,432.0
CCCCC1(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCO,420.0
CCCCC1(CCCC)c2cc(C#Cc3ccc(/C=C(\C)c4ccccc4)cc3)ccc2-c2ccc(C#Cc3ccc(/C=C(\C)c4ccccc4)cc3)cc21,C1CCOC1,365.0
CCCCC1(CCCC)c2cc(C#Cc3ccc(C=C(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C#Cc3ccc(C=C(c4ccccc4)c4ccccc4)cc3)cc21,C1CCOC1,376.0
CCCCC1(CCCC)c2cc(C#Cc3ccc(C=C4c5ccccc5-c5ccccc54)cc3)ccc2-c2ccc(C#Cc3ccc(C=C4c5ccccc5-c5ccccc54)cc3)cc21,C1CCOC1,380.0
CCCCC1(CCCC)c2cc(C#Cc3ccc(C=C4c5ccccc5C=Cc5ccccc54)cc3)ccc2-c2ccc(C#Cc3ccc(C=C4c5ccccc5C=Cc5ccccc54)cc3)cc21,C1CCOC1,370.0
CCCCC1(CCCC)c2cc(C#Cc3ccc(C=C4c5ccccc5CCc5ccccc54)cc3)ccc2-c2ccc(C#Cc3ccc(C=C4c5ccccc5CCc5ccccc54)cc3)cc21,C1CCOC1,368.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,C1CCCCC1,418.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,C1CCOC1,421.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,CC#N,420.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,CCOC(C)=O,419.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,CN(C)C=O,427.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,Cc1ccccc1,424.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,ClC(Cl)Cl,421.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,ClCCl,424.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,418.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,413.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,407.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCOC(C)=O,411.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CN(C)C=O,411.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,418.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClC(Cl)Cl,412.0
CCCCC1(CCCC)c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,410.0
CCCCC1(CCCC)c2cc(C(=O)O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,CCO,369.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-c3c4c(nc5ccccc35)-c3cc5c(cc3CC4)-c3nc4ccccc4c(-c4ccc6c(c4)C(CCCC)(CCCC)c4ccccc4-6)c3CC5)cc21,ClC(Cl)Cl,377.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-c3ccc4c(c3)C(=O)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)cc21,C1CCOC1,366.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-n3c4cc(/C=C(/C#N)C(=O)O)sc4c4sc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc43)cc21,C1CCOC1,495.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-n3c4cc(/C=C(\C#N)C(=O)O)sc4c4sc(-c5ccc6c7c(cccc57)C(=O)N(c5ccc7c(c5)c5ccccc5n7CC)C6=O)cc43)cc21,ClCCl,481.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-n3c4ccsc4c4sc(-c5cc6c(s5)c5sc(-c7cc8c(s7)c7sc(/C=C(\C#N)C(=O)O)cc7n8-c7ccc8c(c7)C(CCCC)(CCCC)c7ccccc7-8)cc5n6-c5ccc6c(c5)C(CCCC)(CCCC)c5ccccc5-6)cc43)cc21,C1CCOC1,524.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-n3c4ccsc4c4sc(-c5cc6c(s5)c5sc(/C=C(\C#N)C(=O)O)cc5n6-c5ccc6c(c5)C(CCCC)(CCCC)c5ccccc5-6)cc43)cc21,C1CCOC1,499.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-n3c4ccsc4c4sc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc43)cc21,C1CCOC1,487.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-n3c4ccsc4c4sc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc43)cc21,C1CCOC1,473.0
CCCCC1(CCCC)c2ccccc2-c2ccc(-n3c4ccsc4c4sc(/C=C(\C#N)C(=O)O)cc43)cc21,C1CCOC1,431.0
CCCCC1(CCCC)c2ccccc2-c2ccc(N3c4ccc(-c5ccc(/C=c6/sc(=O)n(CC(=O)O)/c6=c6\sc(=C(C#N)C#N)n(CCCCCCCC(=O)O)c6=O)s5)cc4C4CCCC43)cc21,ClC(Cl)Cl,566.0
CCCCC1(CCCC)c2ccccc2-c2ccc(N3c4ccc(/C=C5\C(=O)N(CC(=O)O)C(=O)C(C#N)=C5C)cc4C4CCCC43)cc21,ClC(Cl)Cl,577.0
CCCCC1(CCCC)c2ccccc2-c2ccc(N3c4ccc(/C=c5\s/c(=c6/sc(=C(C#N)C#N)n(CCCCCCCC(=O)O)c6=O)n(CC(=O)O)c5=O)cc4C4CCCC43)cc21,ClC(Cl)Cl,566.0
CCCCC1(c2ccc(OC)cc2)Nc2ccccc2N=C1c1ccc(OC)cc1,ClC(Cl)Cl,372.0
CCCCC1(c2ccccc2)Nc2c(-c3ccc(N(C)c4ccccc4)cc3)ccc(-c3ccc(N(C)c4ccccc4)cc3)c2N=C1c1ccccc1,ClC(Cl)Cl,380.0
CCCCC1(c2ccccc2)Nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2N=C1c1ccccc1,ClC(Cl)Cl,370.0
CCCCC1(c2ccccc2)Nc2c(-c3ccc(OC)cc3)ccc(-c3ccc(OC)cc3)c2N=C1c1ccccc1,ClC(Cl)Cl,400.0
CCCCC1(c2ccccc2)Nc2ccccc2N=C1c1ccccc1,ClC(Cl)Cl,386.0
CCCCC1=C(C#N)C(=O)N(CC(=O)O)C(=O)/C1=C\c1ccc2c(c1)C1CCCC1N2c1ccc2c(c1)C(CCCC)(CCCC)c1ccccc1-2,ClC(Cl)Cl,577.0
CCCCC1=C(CCCC)c2cccc3c2c(cc2nc4ccccc4nc23)O1,ClCCl,503.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,C1CCCCC1,431.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,C1CCOC1,432.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,C1COCCO1,432.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,CC#N,428.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,CC(C)=O,429.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,CO,428.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,Cc1ccccc1,434.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,ClC(Cl)Cl,433.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)n(c26)P1(=O)c1ccccc1)c3c45,ClCCl,431.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,C1CCCCC1,430.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,C1CCOC1,430.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,C1COCCO1,430.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,CC#N,426.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,CC(C)=O,427.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,CO,426.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,Cc1ccccc1,433.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,ClC(Cl)Cl,431.0
CCCCC1=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n(c26)P1(=O)c1ccccc1)c3c45,ClCCl,430.0
CCCCCC#Cc1cc(C#CCCCCC)c2ccc3c(C(=O)c4ccccc4)cc(C#CCCCCC)c4ccc1c2c43,ClCCl,416.0
CCCCCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,427.5
CCCCCC(=O)Oc1cc2[nH]c(cc2CCOC)c2nc(ccc3[nH]c(cc3CCOC)c3nc1C(CCOC)=C3)C(CCOC)=C2,Cc1ccccc1,646.0
CCCCCC(=O)c1c2c(c(C(=O)CCCCC)c3c1OC1(CCCC1)O3)OC1(CCCC1)O2,CC#N,444.0
CCCCCC(=O)c1c2c(c(C(=O)CCCCC)c3c1OC1(CCCC1)O3)OC1(CCCC1)O2,CCCCCC,435.0
CCCCCC(=O)c1c2c(c(C(=O)CCCCC)c3c1OC1(CCCC1)O3)OC1(CCCC1)O2,CCO,452.0
CCCCCC(=O)c1c2c(c(C(=O)CCCCC)c3c1OC1(CCCC1)O3)OC1(CCCC1)O2,CO,452.0
CCCCCC(=O)c1c2c(c(C(=O)CCCCC)c3c1OC1(CCCC1)O3)OC1(CCCC1)O2,ClCCl,449.0
CCCCCC(CC)C1(C(CC)CCCCC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(C(CC)CCCCC)(C(CC)CCCCC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)c6ccc3c4c65)cc21,C1CCCCC1,486.0
CCCCCC(CC)C1(C(CC)CCCCC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(C(CC)CCCCC)(C(CC)CCCCC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)c6ccc3c4c65)cc21,C1CCOC1,492.0
CCCCCC(CC)C1(C(CC)CCCCC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(C(CC)CCCCC)(C(CC)CCCCC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)c6ccc3c4c65)cc21,CCOC(C)=O,488.0
CCCCCC(CC)C1(C(CC)CCCCC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(C(CC)CCCCC)(C(CC)CCCCC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)c6ccc3c4c65)cc21,CN(C)C=O,496.0
CCCCCC(CC)C1(C(CC)CCCCC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(C(CC)CCCCC)(C(CC)CCCCC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)c6ccc3c4c65)cc21,Cc1ccccc1,488.0
CCCCCC(CC)C1(C(CC)CCCCC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(C(CC)CCCCC)(C(CC)CCCCC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)c6ccc3c4c65)cc21,ClC(Cl)Cl,491.0
CCCCCC(CC)C1(C(CC)CCCCC)c2ccccc2-c2ccc(C#Cc3cc(C#Cc4ccc5c(c4)C(C(CC)CCCCC)(C(CC)CCCCC)c4ccccc4-5)c4ccc5c(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)cc(C#Cc6ccc7c(c6)C(C(CC)CCCCC)(C(CC)CCCCC)c6ccccc6-7)c6ccc3c4c65)cc21,ClCCl,492.0
CCCCCC(CC)COc1ccc(-c2ccc(/C(=C\c3ccc(N4c5ccc(-c6cnc(-c7ccc(/C=C(\C#N)C(=O)O)s7)c7nccnc67)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCC(CC)CCCCC)cc4OC(CC)CCCCC)cc3)cc2)c(OCC(CC)CCCCC)c1,ClCCl,571.0
CCCCCC(CC)COc1ccc(-c2ccc(/C(=C\c3ccc(N4c5ccc(-c6ncc(-c7ccc(/C=C(\C#N)C(=O)O)s7)c7nccnc67)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCC(CC)CCCCC)cc4OC(CC)CCCCC)cc3)cc2)c(OCC(CC)CCCCC)c1,ClCCl,557.0
CCCCCC(CC)COc1ccc(N(c2ccc(OCC(CC)CCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)s5)c5nsnc45)s3)cc2)cc1,C1CCOC1,535.0
CCCCCC(CC)N1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)N(C(CC)CCCCC)C(=O)C2=C1c1ccc(-c2ccc3c4c(-c5ccccc5)c5c(c(-c6ccccc6)c4n(C(CC)CCCCC)c3c2)c2ccccc2n5C(CC)CCCCC)cc1,ClCCl,521.0
CCCCCC(CC)N1C(=O)C2=C(c3ccc(-c4ccc5c6c(-c7ccccc7)c7c(c(-c8ccccc8)c6n(C(CC)CCCCC)c5c4)c4ccccc4n7C(CC)CCCCC)cc3)N(C(CC)CCCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,ClCCl,508.0
CCCCCC(CC)n1c2ccc(OC)cc2c2cc(-c3ccc(C=C(C#N)C(=O)O)o3)c3ccccc3c21,ClCCl,462.0
CCCCCC(CC)n1c2ccc(OC)cc2c2cc(-c3ccc(C=C(C#N)C(=O)O)s3)c3ccccc3c21,ClCCl,458.0
CCCCCC(CCCCC)N1C(=O)c2c(Oc3c(-c4ccccc4)cccc3-c3ccccc3)cc3c4cc(Oc5c(-c6ccccc6)cccc5-c5ccccc5)c5c6c(c(Oc7c(-c8ccccc8)cccc7-c7ccccc7)cc(c7cc(Oc8c(-c9ccccc9)cccc8-c8ccccc8)c(c2c37)C1=O)c64)C(=O)N(C(CCCCC)CCCCC)C5=O,Cc1ccccc1,535.0
CCCCCC/C=C/c1cc(N(c2ccc(OC)cc2)c2ccc(OC)cc2)ccc1-c1cc2c(s1)c1sc(C=C(C#N)C(=O)O)cc1n2CCCCCC,ClCCl,492.0
CCCCCC/C=C/c1cc(N(c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2c4c(c5c(c2-3)C(CCCCCC)(CCCCCC)c2ccccc2-5)C(CCCCCC)(CCCCCC)c2ccccc2-4)c2ccc3c4ccccc4n(CCCCCC)c3c2)ccc1-c1cc2c(s1)c1sc(C=C(C#N)C(=O)O)cc1n2CCCCCC,ClCCl,518.0
CCCCCC1(CCCCC)c2cc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)ccc2-c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)cc21,CN(C)C=O,385.0
CCCCCC1=C2C(C)=C(c3ccc4c(c3)Sc3ccccc3N4CCC)C(C)=[N+]2[B-](F)(F)n2c(C)c(/C=C(\C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,532.0
CCCCCC1=C2C(C)=C(c3ccc4c(c3)Sc3ccccc3N4CCCCCCN3c4ccccc4Sc4cc(C5=C(C)C6=C(CCCCC)c7c(C)c(-c8ccc(/C=C(\C#N)C(=O)O)s8)c(C)n7[B-](F)(F)[N+]6=C5C)ccc43)C(C)=[N+]2[B-](F)(F)n2c(C)c(/C=C(\C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,535.0
CCCCCC1=C2C(C)=C(c3ccc4c(c3)Sc3ccccc3N4CCCCCCN3c4ccccc4Sc4cc(C5=C(C)C6=C(CCCCC)c7c(C)c(/C=C(\C#N)C(=O)O)c(C)n7[B-](F)(F)[N+]6=C5C)ccc43)C(C)=[N+]2[B-](F)(F)n2c(C)c(/C=C(\C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,532.0
CCCCCC1=C2C(C)=C(c3ccc4c(c3)c3ccccc3n4-c3ccc(OC)cc3)C(C)=[N+]2[B-](F)(F)n2c(C)c(/C=C(\C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,529.0
CCCCCC1=C2C(C)=C(c3ccc4c(c3)c3ccccc3n4-c3ccc(OC)cc3)C(C)=[N+]2[B-](F)(F)n2c(C)c(C=C(C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,529.0
CCCCCC1=C2C(C)=C(c3ccc4c5cc(OC)ccc5n(CCC)c4c3)C(C)=[N+]2[B-](F)(F)n2c(C)c(-c3ccc(/C=C(\C#N)C(=O)O)o3)c(C)c21,ClC(Cl)Cl,554.0
CCCCCC1=C2C(C)=C(c3ccc4c5ccccc5n(-c5ccc(OC)cc5)c4c3)C(C)=[N+]2[B-](F)(F)n2c(C)c(/C=C(\C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,533.0
CCCCCC1=C2C(C)=C(c3ccc4c5ccccc5n(-c5ccc(OC)cc5)c4c3)C(C)=[N+]2[B-](F)(F)n2c(C)c(C=C(C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,533.0
CCCCCC1c2c(C)c(-c3ccc(/C=C(/C#N)C(=O)O)o3)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc4c(c3)Sc3cc(C5=C(C)C6C(CCCCC)c7c(C)c(-c8ccc(/C=C(\C#N)C(=O)O)o8)c(C)n7[B-](F)(F)[N+]6=C5C)ccc3N4CCC)=C(C)C12,ClCCl,555.0
CCCCCC1c2c(C)c(-c3ccc(/C=C(/C#N)C(=O)O)o3)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc4c(c3)Sc3ccccc3N4CCC)=C(C)C12,ClC(Cl)Cl,553.0
CCCCCC1c2c(C)c(-c3ccc(/C=C(/C#N)C(=O)O)s3)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc4c(c3)Sc3ccccc3N4CCC)=C(C)C12,ClC(Cl)Cl,536.0
CCCCCC1c2c(C)c(-c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)o3)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc4c(c3)Sc3ccccc3N4CCC)=C(C)C12,ClC(Cl)Cl,556.0
CCCCCC1c2c(C)c(-c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)s3)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc4c(c3)Sc3ccccc3N4CCC)=C(C)C12,ClC(Cl)Cl,541.0
CCCCCC1c2c(C)c(/C=C(/C#N)C(=O)O)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc4c(c3)Sc3ccccc3N4CCC)=C(C)C12,ClCCl,530.0
CCCCCC1c2c(C)c(/C=C(\C#N)C(=O)O)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc4c(c3)Sc3cc(C5=C(C)C6C(CCCCC)c7c(C)c(/C=C(\C#N)C(=O)O)c(C)n7[B-](F)(F)[N+]6=C5C)ccc3N4CCC)=C(C)C12,ClCCl,534.0
CCCCCC1c2c(C)c(C=C(C#N)C(=O)O)c(C)n2[B-](F)(F)[N+]2=C(C)C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)=C(C)C12,ClC(Cl)Cl,472.0
CCCCCCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,428.0
CCCCCCC(CCCC)COc1ccc(N(c2ccc(OCC(CCCC)CCCCCC)cc2)c2ccc3c4ccc(C#Cc5ccc(C(=O)O)cc5)c5cccc(c6cccc2c63)c54)cc1,C1CCOC1,520.0
CCCCCCC(CCCC)COc1ccc(N(c2ccc(OCC(CCCC)CCCCCC)cc2)c2ccc3c4ccc(C#Cc5ccc(C(=O)O)s5)c5cccc(c6cccc2c63)c54)cc1,C1CCOC1,525.0
CCCCCCC(CCCC)COc1ccc(N(c2ccc(OCC(CCCC)CCCCCC)cc2)c2ccc3c4ccc(C#Cc5ccc(C=C(C#N)C(=O)O)cc5)c5cccc(c6cccc2c63)c54)cc1,C1CCOC1,528.0
CCCCCCC(CCCC)COc1ccc(N(c2ccc(OCC(CCCC)CCCCCC)cc2)c2ccc3c4ccc(C#Cc5ccc(C=C(C#N)C(=O)O)s5)c5cccc(c6cccc2c63)c54)cc1,C1CCOC1,545.0
CCCCCCC(CCCC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc2c3nonc3c3cc(-c4sc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4CC(CCCC)CCCCCC)sc3c2s1,C1CCOC1,462.0
CCCCCCC(CCCC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc2c3nonc3c3cc(-c4sc(-c5ccc6c(c5)Sc5ccccc5N6CC)cc4CC(CCCC)CCCCCC)sc3c2s1,C1CCOC1,463.0
CCCCCCC(CCCC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc2c3nonc3c3cc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4CC(CCCC)CCCCCC)sc3c2s1,C1CCOC1,462.0
CCCCCCC(CCCCCC)N1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c(=O)n6c7cc(OC)c(OC)cc7nc6c6cc(Oc7ccc(C(C)(C)C)cc7)c(c7c(Oc8ccc(C(C)(C)C)cc8)cc(c2c37)C1=O)c4c56,ClCCl,581.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4cc(OC)c(OC)c(OC)c4)ccc(c23)C1=O,CCCCCC,354.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4cc(OC)c(OC)c(OC)c4)ccc(c23)C1=O,CCCCCCCCCCCCCC,357.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4cc(OC)c(OC)c(OC)c4)ccc(c23)C1=O,CCCCCCCCCCCO,362.6
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4cc(OC)c(OC)c(OC)c4)ccc(c23)C1=O,CCCCO,361.4
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4cc(OC)c(OC)c(OC)c4)ccc(c23)C1=O,CN(C)C=O,365.6
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4cc(OC)c(OC)c(OC)c4)ccc(c23)C1=O,Cc1ccccc1,360.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4cc(OC)c(OC)c(OC)c4)ccc(c23)C1=O,ClC(Cl)Cl,362.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(N(C)C)cc4)ccc(c23)C1=O,CCCCCC,401.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(N(C)C)cc4)ccc(c23)C1=O,CCCCCCCCCCCCCC,403.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(N(C)C)cc4)ccc(c23)C1=O,CCCCCCCCCCCO,428.6
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(N(C)C)cc4)ccc(c23)C1=O,CCCCO,430.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(N(C)C)cc4)ccc(c23)C1=O,CN(C)C=O,433.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(N(C)C)cc4)ccc(c23)C1=O,Cc1ccccc1,418.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(N(C)C)cc4)ccc(c23)C1=O,ClC(Cl)Cl,426.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)c5cccc(C)c45)ccc(c23)C1=O,CCCCCC,326.6
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)c5cccc(C)c45)ccc(c23)C1=O,CCCCCCCCCCCCCC,327.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)c5cccc(C)c45)ccc(c23)C1=O,CCCCCCCCCCCO,329.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)c5cccc(C)c45)ccc(c23)C1=O,CCCCO,327.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)c5cccc(C)c45)ccc(c23)C1=O,CN(C)C=O,328.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)c5cccc(C)c45)ccc(c23)C1=O,Cc1ccccc1,328.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)c5cccc(C)c45)ccc(c23)C1=O,ClC(Cl)Cl,329.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)cc4)ccc(c23)C1=O,CCCCCC,354.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)cc4)ccc(c23)C1=O,CCCCCCCCCCCCCC,356.4
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)cc4)ccc(c23)C1=O,CCCCCCCCCCCO,365.6
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)cc4)ccc(c23)C1=O,CCCCO,366.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)cc4)ccc(c23)C1=O,CN(C)C=O,368.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)cc4)ccc(c23)C1=O,Cc1ccccc1,364.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc(OC)cc4)ccc(c23)C1=O,ClC(Cl)Cl,364.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc([Si](C)(C)C)cc4)ccc(c23)C1=O,CCCCCC,343.4
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc([Si](C)(C)C)cc4)ccc(c23)C1=O,CCCCCCCCCCCCCC,344.4
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc([Si](C)(C)C)cc4)ccc(c23)C1=O,CCCCCCCCCCCO,355.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc([Si](C)(C)C)cc4)ccc(c23)C1=O,CCCCO,357.6
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc([Si](C)(C)C)cc4)ccc(c23)C1=O,CN(C)C=O,356.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc([Si](C)(C)C)cc4)ccc(c23)C1=O,Cc1ccccc1,353.4
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccc([Si](C)(C)C)cc4)ccc(c23)C1=O,ClC(Cl)Cl,356.0
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccccc4)ccc(c23)C1=O,CCCCCC,342.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccccc4)ccc(c23)C1=O,CCCCCCCCCCCCCC,343.4
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccccc4)ccc(c23)C1=O,CCCCCCCCCCCO,353.4
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccccc4)ccc(c23)C1=O,CCCCO,355.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccccc4)ccc(c23)C1=O,CN(C)C=O,355.2
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccccc4)ccc(c23)C1=O,Cc1ccccc1,346.8
CCCCCCC(CCCCCC)N1C(=O)c2cccc3c(-c4ccccc4)ccc(c23)C1=O,ClC(Cl)Cl,355.4
CCCCCCC1(CCCCCC)COc2c(/C=C(\C#N)C(=O)O)sc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCC(CCCCCC)(CCCCCC)CO4)c2OC1,C1CCOC1,502.0
CCCCCCC1(CCCCCC)c2cc(-c3cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,466.0
CCCCCCC1(CCCCCC)c2cc(-c3cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(/C=C(\C#N)C(=O)O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,419.0
CCCCCCC1(CCCCCC)c2cc(-c3cc4c(s3)c3sc(/C=C(/C#N)C(=O)O)cc3n4-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)ccc2-c2ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)cc21,C1CCOC1,516.0
CCCCCCC1(CCCCCC)c2cc(-c3cc4c(s3)c3sc(/C=C(/C#N)C(=O)O)cc3n4-c3ccc(OC)cc3)ccc2-c2ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(OC)cc3)cc21,C1CCOC1,514.0
CCCCCCC1(CCCCCC)c2cc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)ccc2-c2ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)cc21,C1CCOC1,516.0
CCCCCCC1(CCCCCC)c2cc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(OC)cc3)ccc2-c2ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(OC)cc3)cc21,C1CCOC1,514.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(-c4cc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,426.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7c(c6)C(CCCCCC)(CCCCCC)c6cc(-n8c9ccc(-n%10c%11ccccc%11c%11ccccc%11%10)cc9c9cc(-n%10c%11ccccc%11c%11ccccc%11%10)ccc98)ccc6-7)s5)c5nsnc45)s3)ccc2-c2ccc(-n3c4ccc(-n5c6ccccc6c6ccccc65)cc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)cc21,ClCCl,514.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,C1CCOC1,473.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(-c4ccc(C=C(C#N)C#N)s4)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc(C(=O)O)cc3)cc21,C1CCOC1,489.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(-n4c(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4/C=C(\C#N)C(=O)O)cc3)ccc2-c2ccc(-c3ccc(-n4c(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4/C=C(\C#N)C(=O)O)cc3)cc21,ClCCl,444.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-c2c1c1c(c3c2C(CCCCCC)(CCCCCC)c2cc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc2-3)C(CCCCCC)(CCCCCC)c2cc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)ccc2-1,ClCCl,430.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(/C=C/C(=O)O)cc3)ccc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClCCl,351.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(/C=C/C4=CC(=C(C#N)C#N)C=C(/C=C/c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)O4)cc3)ccc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClCCl,467.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(/C=C/C4=CC(=C(C#N)C#N)C=C(/C=C/c5ccc(-c6ccc(C=CC(=O)O)s6)s5)O4)cc3)ccc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClCCl,455.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(C=C(C#N)C#N)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc(C(=O)O)cc3)cc21,C1CCOC1,461.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(C=C(C#N)C(=O)O)cc3)ccc2-c2ccc(N(c3ccc(CCCC)cc3)c3ccc(CCCC)cc3)cc21,ClCCl,441.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(C=C4C(=O)N(CC)C(=S)N(CC)C4=O)s3)ccc2-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc21,C1CCOC1,504.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(C=C4C(=O)N(CC)C(=S)N(CC)C4=O)s3)ccc2-c2ccc(N(c3ccccc3)c3ccc(C(=O)O)cc3)cc21,C1CCOC1,508.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(N(c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)c4ccc(-c5ccc6c(c5)C(CCCCCC)(CCCCCC)c5cc(-n7c8ccc(C(C)(C)C)cc8c8cc(C(C)(C)C)ccc87)ccc5-6)s4)s3)ccc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClCCl,438.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(N(c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)cc3)sc2-c2sc(-c3ccc(/C=C(\C#N)C(=O)O)c(F)c3)cc21,ClCCl,534.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2c1c1c(c3c2C(CCCCCC)(CCCCCC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)C(CCCCCC)(CCCCCC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2-1,ClC(Cl)Cl,440.0
CCCCCCC1(CCCCCC)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2c1c1c(c3c2C(CCCCCC)(CCCCCC)c2cc(-c4ccc(/C=C5\ON(CC(=O)O)C(=S)S5)s4)ccc2-3)C(CCCCCC)(CCCCCC)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-1,ClC(Cl)Cl,480.0
CCCCCCC1(CCCCCC)c2cc(-c3ccncc3)sc2-c2cc(-c3ccc(N(c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)cc3)sc21,C1CCOC1,442.0
CCCCCCC1(CCCCCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4cc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)ccc4-5)nc(-c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4cc(-n6c7ccc(C(C)(C)C)cc7c7cc(C(C)(C)C)ccc76)ccc4-5)n3)ccc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,C1CCOC1,382.0
CCCCCCC1(CCCCCC)c2cc(-c3nc(-c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)nc(-c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4cc(N6c7ccccc7Sc7ccccc76)ccc4-5)n3)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,C1CCOC1,400.0
CCCCCCC1(CCCCCC)c2cc(-c3nc4cc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)cnc4nc3-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,435.0
CCCCCCC1(CCCCCC)c2cc(-c3nc4cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cnc4nc3-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,457.0
CCCCCCC1(CCCCCC)c2cc(-c3nc4cc5c(cc4nc3-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(N(c6ccccc6)c6ccccc6)ccc3-4)C(CCCCCC)(CCCCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)ccc3-5)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,427.0
CCCCCCC1(CCCCCC)c2cc(-c3nc4cc5c(cc4nc3-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(N(c6ccccc6)c6ccccc6)ccc3-4)C(CCCCCC)(CCCCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3-5)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,445.0
CCCCCCC1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)c4nsnc34)cc21,ClCCl,496.0
CCCCCCC1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)cc3)cc21,CCO,520.0
CCCCCCC1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)cc3)cc21,ClCCl,520.0
CCCCCCC1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccc5c(c4)Cc4cc(OCCCC)cc(OCCCC)c4-5)c4ccc5c(c4)C(C)(C)c4cc(OCCCC)cc(OCCCC)c4-5)cc3)cc21,CCO,534.0
CCCCCCC1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc4c(c3)Sc3cc(-c5cc6c(s5)-c5sc(/C=C(\C#N)C(=O)O)cc5C6(CCCCCC)CCCCCC)ccc3N4c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)cc21,C1CCOC1,527.0
CCCCCCC1(CCCCCC)c2cc(/C=C(\C#N)c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClCCl,477.0
CCCCCCC1(CCCCCC)c2cc(/C=C(\C#N)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2-c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClCCl,476.4
CCCCCCC1(CCCCCC)c2cc(/C=C/c3ccc(N(c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)c4ccc(-c5ccc(OCCCC)cc5OCCCC)cc4)cc3)sc2-c2sc(/C=C(\C#N)C(=O)O)cc21,CO,542.0
CCCCCCC1(CCCCCC)c2cc(C=C(C#N)C#N)sc2-c2sc(-c3ccc(N(c4ccc(C(=O)O)cc4)c4ccc(C(=O)O)cc4)cc3)cc21,C1CCOC1,514.0
CCCCCCC1(CCCCCC)c2ccc(N(c3ccccc3)c3ccccc3)cc2-c2c1c1c(c3c2C(CCCCCC)(CCCCCC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)C(CCCCCC)(CCCCCC)c2ccc(C=C(C#N)C(=O)O)cc2-1,C1CCOC1,383.0
CCCCCCC1(CCCCCC)c2ccccc2-c2c1c1c(c3c2C(CCCCCC)(CCCCCC)c2cc(N(c4ccc(OC)cc4)c4ccc(-c5sc(C=C(C#N)C(=O)O)c6c5OCCO6)cc4)ccc2-3)C(CCCCCC)(CCCCCC)c2ccccc2-1,ClCCl,482.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5ccc6c(c5)C(CCCCCC)(CCCCCC)c5ccccc5-6)ccc3-4)cc21,Cc1ccccc1,366.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5ccc6c(c5)C(CCCCCC)(CCCCCC)c5ccccc5-6)ccc3-4)cc21,ClC(Cl)Cl,367.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(C#Cc3ccc(N(c4ccc(C#Cc5ccc6c(c5)C(CCCCCC)(CCCCCC)c5ccccc5-6)cc4)c4ccc(C=C(C#N)C(=O)O)cc4)cc3)cc21,ClCCl,428.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(/C3=c4\cc/c5n4[Zn]n4c(ccc4/C(c4cc(C(C)(C)C)cc(C(C)(C)C)c4)=C4/C=CC3=N4)/C(C#Cc3ccc(C(=O)O)cc3)=C3/C=CC(=N3)/C=5c3cc(C(C)(C)C)cc(C(C)(C)C)c3)c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3ccccc3-4)cc21,CC#N,439.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(C=C(C#N)C(=O)O)o4)cc3)c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3ccccc3-4)cc21,ClCCl,449.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(C=C5SC(=S)N(CC(=O)O)C5=O)o4)cc3)c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3ccccc3-4)cc21,ClCCl,533.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N3c4ccc(/C=C(\C#N)C(=O)O)cc4Sc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc43)cc21,ClCCl,487.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N3c4ccccc4Sc4cc(/C=C(\C#N)C(=O)O)ccc43)cc21,ClCCl,478.0
CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N3c4ccccc4Sc4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)cc43)cc21,ClCCl,493.0
CCCCCCC1(CCCCCC)c2ccsc2-c2sc(-c3cc4c(s3)-c3sc(-c5cc6c(s5)-c5sc(/C=C(/C#N)C(=O)O)cc5C6(CCCCCC)CCCCCC)cc3C4(CCCCCC)CCCCCC)cc21,ClCCl,585.0
CCCCCCC1(CCCCCC)c2ccsc2-c2sc(-c3cc4c(s3)-c3sc(/C=C(/C#N)C(=O)O)cc3C4(CCCCCC)CCCCCC)cc21,ClCCl,546.0
CCCCCCC1=C2C(C)=C(c3ccc(-c4nc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)n4CC)cc3)C(C)=[N+]2[B-](F)(F)n2c(C)c(C=C(C#N)C(=O)O)c(C)c21,ClC(Cl)Cl,531.0
CCCCCCC1=CC(C=O)(/C=C(\C#N)C(=O)O)SC1=c1cc(CCCCCC)c(=C2C=C(CCCCCC)C(c3cc4ccc(N(c5ccc6c(c5)C(C)(C)c5ccccc5-6)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4s3)S2)s1,C1CCOC1,430.0
CCCCCCC1CC(C)(CCCCCC)N(C)c2cc(CCC(=O)O)c(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc21,ClC(Cl)Cl,615.0
CCCCCCC1CC(C)(CCCCCC)N(C)c2cc(OC)c(/C=C(/C#N)C(=O)O)cc21,ClCCl,435.0
CCCCCCC1CC(C)(CCCCCC)N(C)c2cc(OC)c(/C=C/C3=C/C(=C(\C#N)C(=O)O)c4ccccc4O3)cc21,CCO,455.0
CCCCCCC1CC(C)(CCCCCC)N(C)c2cc(OC)c(/C=C/c3cc[n+](CC(=O)O)cc3)cc21,ClCCl,521.0
CCCCCCC1CC(C)(CCCCCC)N(C)c2ccc(-c3ccc(/C=C/C4=C/C(=C(\C#N)C(=O)O)CC(C)(C)C4)s3)cc21,ClCCl,473.0
CCCCCCC1CC(C)(CCCCCC)N(C)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc21,ClCCl,535.0
CCCCCCC1CC(C)(CCCCCC)N(C)c2ccc(/C=C/c3cc[n+](CC(=O)O)cc3)cc21,ClCCl,504.0
CCCCCCCC(CCCCCCC)C1c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4cc5c(s4)-c4sccc4C5(C)C)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc21,ClCCl,579.0
CCCCCCCC(CCCCCCC)N1C(=O)c2c(Br)cc3c4cc(Br)c5c6c(c(Br)cc(c7cc(Br)c(c2c37)C1=O)c64)C(=O)N(C(CCCCCCC)CCCCCCC)C5=O,ClCCl,509.0
CCCCCCCC(CCCCCCC)N1C(=O)c2c(C#N)cc3c4cc(C#N)c5c6c(c(C#N)cc(c7cc(C#N)c(c2c37)C1=O)c64)C(=O)N(C(CCCCCCC)CCCCCCC)C5=O,ClCCl,518.0
CCCCCCCC(CCCCCCC)N1C(=O)c2c(Cl)cc3c4cc(Cl)c5c6c(c(Cl)cc(c7cc(Cl)c(c2c37)C1=O)c64)C(=O)N(C(CCCCCCC)CCCCCCC)C5=O,ClCCl,505.0
CCCCCCCC(CCCCCCC)N1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(C(CCCCCCC)CCCCCCC)C5=O,ClCCl,526.0
CCCCCCCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC)c(C)c1c2=O,C1CCCCC1,393.0
CCCCCCCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC)c(C)c1c2=O,CO,397.0
CCCCCCCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC)c(C)c1c2=O,CS(C)=O,397.0
CCCCCCCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC)c(C)c1c2=O,ClC(Cl)Cl,396.0
CCCCCCCC1=C(C)C(=O)n2c1cc1[nH]c(C(=O)OC)c(C)c1c2=O,c1ccccc1,395.0
CCCCCCCCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,427.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,C1CCOC1,378.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,C1COCCO1,378.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,CC#N,380.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,CCO,383.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,CN(C)C=O,385.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,CO,384.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,Cc1ccccc1,383.0
CCCCCCCCC(=O)c1ccc2c(c1)C(C)(C)c1cc(N(CC)CC)ccc1-2,ClCCl,384.0
CCCCCCCCC(=O)c1ccc2cc3cc(N(C)C)ccc3cc2c1,CC#N,441.0
CCCCCCCCC(=O)c1ccc2cc3cc(N(C)C)ccc3cc2c1,CCCCCC,428.0
CCCCCCCCC(=O)c1ccc2cc3cc(N(C)C)ccc3cc2c1,CCO,443.0
CCCCCCCCC(=O)c1ccc2cc3cc(N(C)C)ccc3cc2c1,ClC(Cl)Cl,443.0
CCCCCCCCC(=O)c1ccc2cc3cc(N(C)C)ccc3cc2c1,c1ccccc1,438.0
CCCCCCCCC(CCCCCC)COc1ccc(-c2cc3c4c5c2cccc5c2cccc5c(C#Cc6ccc(-c7ccc(C(=O)O)cc7)c7nsnc67)cc(c4c52)n3CC(CCCCCC)CCCCCCCC)cc1,C1CCOC1,512.0
CCCCCCCCC(CCCCCC)COc1ccc(-c2cc3c4c5c2cccc5c2cccc5c(C=C(C#N)C(=O)O)cc(c4c52)n3CC(CCCCCC)CCCCCCCC)cc1,C1CCOC1,508.0
CCCCCCCCC(CCCCCC)COc1ccc2c(c1)C(c1ccc(CCCCCC)cc1)(c1ccc(CCCCCC)cc1)c1c-2c2cccc3c4cccc5c(C#Cc6ccc(-c7ccc(C(=O)O)cc7)c7nsnc67)cc6c(c54)c(c23)c1n6CC(CCCCCC)CCCCCCCC,C1CCOC1,536.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3sc2c2sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3c21,C1CCOC1,426.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)cc3sc2c2sc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)ccc3c21,C1CCOC1,504.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)cc3sc2c2sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3c21,C1CCOC1,472.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3sc2c2sc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)ccc3c21,C1CCOC1,507.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3sc2c2sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3c21,C1CCOC1,470.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccccc3sc2c2sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3c21,C1CCOC1,457.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccccc3sc2c2sc3cc(-c4ccc5c(c4)Sc4cc(-c6ccc(/C=C(\C#N)C(=O)O)s6)ccc4N5CC(CC)CCCC)ccc3c21,C1CCOC1,460.0
CCCCCCCCC(CCCCCC)Cn1c2c3ccccc3sc2c2sc3cc(-c4sc(/C=C(\C#N)C(=O)O)cc4CCCCCC)ccc3c21,C1CCOC1,495.0
CCCCCCCCC(CCCCCC)Cn1c2cc(C#Cc3ccc(-c4ccc(C(=O)O)cc4)c4nsnc34)c3cccc4c5cccc6c(-c7ccc8c(c7)-c7ccccc7C8(CC(CCCCCC)CCCCCCCC)CC(CCCCCC)CCCCCCCC)cc1c(c65)c2c34,C1CCOC1,512.0
CCCCCCCCC(CCCCCC)Cn1c2cc(C#Cc3ccc(-c4ccc(C(=O)O)cc4)c4nsnc34)c3cccc4c5cccc6c(N(c7ccc(OCCCCCC)cc7)c7ccc(OCCCCCC)cc7)cc1c(c65)c2c34,C1CCOC1,550.0
CCCCCCCCC(CCCCCC)Cn1c2cc(C#Cc3ccc(C#Cc4ccc(C(=O)O)cc4)c4nsnc34)c3cccc4c5cccc6c(N(c7ccc(OCCCCC)cc7)c7ccc(OCCCCCC)cc7)cc1c(c65)c2c34,C1CCOC1,569.0
CCCCCCCCC(CCCCCC)Cn1c2ccc3cccc4c5cccc6c(C#Cc7ccc(-c8ccc(C(=O)O)cc8)c8nsnc78)cc1c(c65)c2c34,C1CCOC1,498.0
CCCCCCCCC(CCCCCC)Cn1c2ccccc2c2cc(-c3cc4c5c6c3cccc6c3cccc6c(C#Cc7ccc(-c8ccc(C(=O)O)cc8)c8nsnc78)cc(c5c63)n4CC(CCCCCC)CCCCCCCC)ccc21,C1CCOC1,517.0
CCCCCCCCC(CCCCCCCC)n1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)sc2c2sc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,C1CCOC1,557.0
CCCCCCCCC(CCCCCCCC)n1c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)s3)cc2c2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)ccc21,C1CCOC1,484.0
CCCCCCCCC(CCCCCCCC)n1c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)cc2c2cc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc21,C1CCOC1,480.0
CCCCCCCCC(CCCCCCCC)n1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc21,C1CCOC1,480.0
CCCCCCCCC(CCCCCCCC)n1c2ccc(-c3sc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3CCCCCC)cc2c2cc(-c3sc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3CCCCCC)ccc21,C1CCOC1,470.0
CCCCCCCCC(CCCCCCCC)n1c2ccc(-c3sc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3CCCCCC)cc2c2cc(-c3sc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3CCCCCC)ccc21,C1CCOC1,470.0
CCCCCCCCC1(C=C2C(=O)NC(=O)NC2=O)C=CC(NC(=C2C(=O)NC(=O)NC2=O)c2ccccc2)=CC1,C1CCOC1,467.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)sc2-c2cc(-c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)c4nonc34)sc21,ClCCl,568.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C#N)cc3)ccc2-c2ccc(-c3ccc(C#N)cc3)cc21,ClC(Cl)Cl,341.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(=O)OC)cc3)ccc2-c2ccc(-c3ccc(C(=O)OC)cc3)cc21,ClC(Cl)Cl,341.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,C1CCOC1,375.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,C1COCCO1,374.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CC#N,370.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CC(C)=O,371.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CCCCCC,380.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CCCCOCCCC,379.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CCN(CC)CC,376.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CCOC(C)=O,372.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CCOCC,374.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CN(C)C=O,373.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,CS(C)=O,371.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,Cc1ccccc1,379.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,ClC(Cl)Cl,382.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,ClCCl,378.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C(F)(F)F)cc3)ccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(-c5ccc(C(F)(F)F)cc5)ccc3-4)cc21,c1ccccc1,378.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,C1CCOC1,436.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,CC(C)=O,433.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,CCCCCC,419.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,CS(C)=O,441.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,Cc1ccccc1,429.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,ClC(Cl)Cl,444.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(N(C)C)cc3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,ClCCl,422.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)cc3)ccc2-c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)cc3)cc21,C1CCOC1,475.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)cc3)ccc2-c2ccc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)cc3)cc21,C1CCOC1,470.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,ClCCl,431.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc([N+](=O)[O-])cc3)ccc2-c2ccc(-c3ccc([N+](=O)[O-])cc3)cc21,C1CCCCC1,357.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc([N+](=O)[O-])cc3)ccc2-c2ccc(-c3ccc([N+](=O)[O-])cc3)cc21,CCO,368.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc([N+](=O)[O-])cc3)ccc2-c2ccc(-c3ccc([N+](=O)[O-])cc3)cc21,CN(C)C=O,380.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc([N+](=O)[O-])cc3)ccc2-c2ccc(-c3ccc([N+](=O)[O-])cc3)cc21,CS(C)=O,382.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc([N+](=O)[O-])cc3)ccc2-c2ccc(-c3ccc([N+](=O)[O-])cc3)cc21,Cc1ccccc1,365.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc([N+](=O)[O-])cc3)ccc2-c2ccc(-c3ccc([N+](=O)[O-])cc3)cc21,ClC(Cl)Cl,373.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc([Si](C)(C)C)cc3)ccc2-c2ccc(-c3ccc([Si](C)(C)C)cc3)cc21,ClC(Cl)Cl,330.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)ccc2-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,ClCCl,433.0
CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccccc3)cc21,ClC(Cl)Cl,327.0
CCCCCCCCC1(CCCCCCCC)c2cc(/C=C(/C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)[C@H]4CCC[C@H]4N5c4ccc(C)cc4)c4nc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)nc34)cc21,ClCCl,555.0
CCCCCCCCC1(CCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)c4nc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)nc34)cc21,ClCCl,555.0
CCCCCCCCC1(CCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)[C@H]4CCC[C@H]4N5c4ccc(C)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc21,ClCCl,557.0
CCCCCCCCC1(CCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)[C@H]4CCC[C@H]4N5c4ccc(C)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc21,ClCCl,564.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=C(C#N)C(=O)O)cc21,C1CCOC1,389.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,C1CCOC1,377.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,C1COCCO1,383.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CC#N,375.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CC(C)=O,389.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CCCCCC,378.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CCOC(C)=O,381.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CN(C)C=O,382.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CS(C)=O,382.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,Cc1ccccc1,387.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,ClC(Cl)Cl,375.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#CC#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,ClCCl,365.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#C[Pt](C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)([PH](CC)(CC)CC)[PH](CC)(CC)CC)ccc2-c2ccc(/C=C(\C#N)C(=O)O)cc21,C1CCOC1,398.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C#Cc3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3cc(C=C(C#N)C(=O)O)ccc3-4)cc21,C1CCOC1,397.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=C(C#N)C(=O)O)cc21,C1CCOC1,393.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,C1CCOC1,378.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,C1COCCO1,381.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CC#N,378.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CC(C)=O,373.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CCCCCC,384.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CCOC(C)=O,376.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CN(C)C=O,380.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,CS(C)=O,381.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,Cc1ccccc1,388.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,ClC(Cl)Cl,386.0
CCCCCCCCC1(CCCCCCCC)c2cc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2-c2ccc(C=O)cc21,ClCCl,384.0
CCCCCCCCC1(CCCCCCCC)c2cc3c(cc2-c2sc(-c4ccc(/C=C5\SC(=S)N(CC)C5=O)c5nsnc45)cc21)C(CCCCCCCC)(CCCCCCCC)c1cc(-c2ccc(/C=C4\SC(=S)N(CC)C4=O)c4nsnc24)sc1-3,ClC(Cl)Cl,652.0
CCCCCCCCC1(CCCCCCCC)c2cc3c(cc2-c2sc(-c4ccc(/C=C5\SC(N6CCCCC6)=NC5=O)c5nsnc45)cc21)C(CCCCCCCC)(CCCCCCCC)c1cc(-c2ccc(/C=C4\SC(N5CCCCC5)=NC4=O)c4nsnc24)sc1-3,ClC(Cl)Cl,606.0
CCCCCCCCC1(CCCCCCCC)c2cc3c(cc2-c2sc(-c4ccc(/C=C5\SC(SCC)=NC5=O)c5nsnc45)cc21)C(CCCCCCCC)(CCCCCCCC)c1cc(-c2ccc(/C=C4\SC(SCC)=NC4=O)c4nsnc24)sc1-3,ClC(Cl)Cl,639.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(-c3cc(-c4ccc5c(c4)sc4c6ccc(-c7cc(C)c(C=C(C#N)C(=O)O)s7)cc6sc54)sc3-c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,ClC(Cl)Cl,453.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(-c3ccc4c(c3)Sc3cc(-c5ccc6c(c5)C(CCCCCCCC)(CCCCCCCC)c5ccccc5-6)ccc3N4c3ccc4c(c3)sc3c5ccc(-c6cc(C)c(C=C(C#N)C(=O)O)s6)cc5sc43)cc21,ClC(Cl)Cl,420.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(-c3nnc(-c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4)o3)cc21,Cc1ccccc1,352.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(C#Cc3ccc4c(c3)C(=O)c3cc(C#Cc5ccc6c(c5)C(CCCCCCCC)(CCCCCCCC)c5ccccc5-6)ccc3-4)cc21,C1CCOC1,369.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(C#Cc3ccc4c(c3)C(=O)c3cc(C#Cc5ccc6c(c5)C(CCCCCCCC)(CCCCCCCC)c5ccccc5-6)ccc3-4)cc21,C1COCCO1,368.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(C#Cc3ccc4c(c3)C(=O)c3cc(C#Cc5ccc6c(c5)C(CCCCCCCC)(CCCCCCCC)c5ccccc5-6)ccc3-4)cc21,CCCCCC,366.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(C#Cc3ccc4c(c3)C(=O)c3cc(C#Cc5ccc6c(c5)C(CCCCCCCC)(CCCCCCCC)c5ccccc5-6)ccc3-4)cc21,Cc1ccccc1,370.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,C1CCOC1,347.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CC#N,345.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CC(C)=O,345.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CCCCCC,347.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CCCCOCCCC,347.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CCN(CC)CC,347.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CCOC(C)=O,345.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CCOCC,345.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,CN(C)C=O,345.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,Cc1ccccc1,348.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)cc21,ClCCl,348.0
CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(N(c3ccc4c(c3)C(CCCCCCCC)(CCCCCCCC)c3ccccc3-4)c3ccc4c(c3)sc3c5ccc(-c6cc(C)c(C=C(C#N)C(=O)O)s6)cc5sc43)cc21,ClC(Cl)Cl,464.0
CCCCCCCCC1(CCCCCCCC)c2ccsc2-c2sc(-c3ccc(-c4cc5c(s4)-c4sc(/C=C(\C#N)C(=O)O)cc4C5(C)C)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc21,ClCCl,581.0
CCCCCCCCC1(CCCCCCCC)c2ccsc2-c2sc(-c3ccc(-c4cc5c(s4)-c4sc(/C=C(\C#N)C(=O)O)cc4C5C(CCCCCCC)CCCCCCC)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc21,ClCCl,569.0
CCCCCCCCCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,427.5
CCCCCCCCCC1(CCCCCCCC)c2cc(/C=C(/C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc5c(c4)c4ccccc4n5CCCCCC)c4nsnc34)cc21,ClCCl,574.0
CCCCCCCCCC1(CCCCCCCCC)c2cc(C#Cc3ccc(/C=C/c4ccc(N(CCCCCCCC)CCCCCCCC)cc4)cc3)ccc2-c2ccc(C#Cc3ccc(/C=C/c4ccc(N(CCCCCCCC)CCCCCCCC)cc4)cc3)cc21,Cc1ccccc1,411.0
CCCCCCCCCC1(CCCCCCCCC)c2cc(C#Cc3ccc(C#Cc4ccc(N(CCCCCC)CCCCCC)cc4)cc3)ccc2-c2ccc(C#Cc3ccc(C#Cc4ccc(N(CCCCCC)CCCCCC)cc4)cc3)cc21,Cc1ccccc1,387.0
CCCCCCCCCCC(CCCCCCCC)CN1C(=O)C2=C(c3ccc(-c4cccc(C)c4-c4ccc5ccccc5n4)s3)N(CC(CCCCCCCC)CCCCCCCCCC)C(=O)C2=C1c1cccs1,ClCCl,560.0
CCCCCCCCCCC(CCCCCCCC)CN1C(=O)C2=C(c3ccc(-c4sc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)c5c4OCCO5)s3)N(CC(CCCCCCCC)CCCCCCCCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)s1,ClCCl,724.0
CCCCCCCCCCC(CCCCCCCC)CN1C(=O)C2=C(c3cccs3)N(CC(CCCCCCCC)CCCCCCCCCC)C(=O)C2=C1c1cccs1,ClCCl,530.0
CCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(-c3ccc(C(C)(C)C)cc3)c3cccc4c5ccc6c7cc(-c8cc(C(C)(C)C)cc(C(C)(C)C)c8)n8c7c(c7cc1c(c5c76)c2c34)=C1C=CC(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=[N+]1[B-]8(F)F,Cc1ccccc1,780.0
CCCCCCCCCCC1(CCCCCCCC)/C(=C/C2=C([O-])/C(=C\C3=[N+](C)c4ccccc4C3(C)C)C2=O)N(CCCCCC)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc21,ClC(Cl)Cl,667.0
CCCCCCCCCCC1(CCCCCCCC)/C(=C/C2=C([O-])/C(=C\C3=[N+](C)c4ccccc4C3(C)C)C2=O)N(CCCCCCC)c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)cc21,ClC(Cl)Cl,654.0
CCCCCCCCCCC1(CCCCCCCC)C(/C=C/c2cc3c4c(c2)C(C)(C)c2cccc5c2N4c2c(cccc2C3(C)C)C5(C)C)=[N+](CCCCCC)c2ccc(C(=O)O)cc21,CO,606.0
CCCCCCCCCCC1(CCCCCCCC)C(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)=[N+](CCCCCC)c2ccc(C(=O)O)cc21,CO,559.0
CCCCCCCCCCC1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3\N(C)c4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)cc4C3(C)C)=C2[O-])=[N+](CCCCCC)c2ccccc21,ClC(Cl)Cl,654.0
CCCCCCCCCCC1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3\N(C)c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4C3(C)C)=C2[O-])=[N+](CCCCCC)c2ccccc21,ClC(Cl)Cl,665.0
CCCCCCCCCCC1(CCCCCCCC)C(=CC2=C([O-])C(=CC3=[N+](C)c4ccc(-c5ccc(C(=O)O)s5)cc4C3(C)C)C2=C(C#N)C#N)N(CCCCCC)c2ccccc21,ClCCl,705.0
CCCCCCCCCCC1(CCCCCCCC)C(=CC2=C([O-])C(=CC3=[N+](C)c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4C3(C)C)C2=C(C#N)C#N)N(CCCCCC)c2ccccc21,ClCCl,715.0
CCCCCCCCCCC1(CCCCCCCC)C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=O)N(CCCCCC)c2ccc(C(=O)O)cc21,ClCCl,647.0
CCCCCCCCCCC1(CCCCCCCC)C(=CC2=C([O-])C(=CC3=[N+](CCCCCC)c4ccccc4C3(CCCCCCCC)CCCCCCCCCC)C2=O)N(CCCCCC)c2ccc(C(=O)O)cc21,ClCCl,652.0
CCCCCCCCCCC1(CCCCCCCC)C(C=C2C([O-])=C(C=C3N(C)c4ccc(C(=O)O)cc4C3(C)C)C2=C(C#N)C#N)=[N+](CCCCCC)c2ccc(C(=O)O)cc21,ClCCl,707.0
CCCCCCCCCCC1(CCCCCCCC)C(C=C2C([O-])=C(C=C3N(C)c4ccc(C(=O)O)cc4C3(C)C)C2=C(C#N)C#N)=[N+](CCCCCC)c2ccccc21,ClCCl,692.0
CCCCCCCCCCC1(CCCCCCCC)C(C=C2C([O-])=C(C=C3N(C)c4ccc(C(=O)O)cc4C3(C)C)C2=C(C#N)C(=O)OCC)=[N+](CCCCCC)c2ccccc21,ClCCl,697.0
CCCCCCCCCCC1(CCCCCCCC)C(C=C2C([O-])=C(C=C3N(C)c4ccccc4C3(C)C)C2=C(C#N)C#N)=[N+](CCCCCC)c2ccc(C(=O)O)cc21,ClCCl,697.0
CCCCCCCCCCC1(CCCCCCCCCC)C(/C=C2/C(=O)C(c3cc4c5c(c3)C(C)(C)c3cccc6c3N5c3c(cccc3C4(C)C)C6(C)C)=C2[O-])=[N+](CCCCCC)c2ccc(C(=O)O)cc21,CC#N,674.0
CCCCCCCCCCC1(CCCCCCCCCC)c2cc(-c3nc4ccccc4s3)ccc2-c2ccc(N3C(=O)c4ccc5c6ccc7c8c(ccc(c9ccc(c4c59)C3=O)c86)C(=O)N(c3ccc4c(c3)C(CCCCCCCCCC)(CCCCCCCCCC)c3cc(-c5nc6ccccc6s5)ccc3-4)C7=O)cc21,ClCCl,528.0
CCCCCCCCCCC1(CCCCCCCCCC)c2cc(N3C(=O)c4ccc5c6ccc7c8c(ccc(c9ccc(c4c59)C3=O)c86)C(=O)N(c3ccc4c(c3)C(CCCCCCCCCC)(CCCCCCCCCC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)C7=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,528.0
CCCCCCCCCCC1(CCCCCCCCCC)c2cc(N3C(=O)c4ccc5c6ccc7c8c(ccc(c9ccc(c4c59)C3=O)c86)C(=O)N(c3ccc4c(c3)C(CCCCCCCCCC)(CCCCCCCCCC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)C7=O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,527.0
CCCCCCCCCCCC#CC#CCCCCCCCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCCCCCCCC#CC#CCCCCCCCCCCCC)C5=O,ClC(Cl)Cl,526.0
CCCCCCCCCCCCC#CC#CCCCCCCCCCNC(=O)c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)NCCCCCCCCCC#CC#CCCCCCCCCCCCC)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2ccc(C(=O)NCCCCCCCCCC#CC#CCCCCCCCCCCCC)cc2)cc1,Cc1ccccc1,598.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C(C#N)C#N)c3cccc4c5cccc6c(/C=C/C=C(C#N)C#N)cc1c(c65)c2c34,C1CCCCC1,638.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C(C#N)C#N)c3cccc4c5cccc6c(/C=C/C=C(C#N)C#N)cc1c(c65)c2c34,CC#N,599.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C(C#N)C#N)c3cccc4c5cccc6c(/C=C/C=C(C#N)C#N)cc1c(c65)c2c34,Cc1ccccc1,597.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C(C#N)C#N)c3cccc4c5cccc6c(/C=C/C=C(C#N)C#N)cc1c(c65)c2c34,ClCCl,611.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,C1CCCCC1,530.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,CC#N,528.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,Cc1ccccc1,538.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,ClCCl,538.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,C1CCCCC1,517.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,CC#N,516.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,Cc1ccccc1,524.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(/C=C/c3nc4ccccc4s3)c3cccc4c5cccc6c(/C=C/c7nc8ccccc8s7)cc1c(c65)c2c34,ClCCl,521.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(C=C(C#N)C#N)c3cccc4c5cccc6c(C=C(C#N)C#N)cc1c(c65)c2c34,C1CCCCC1,574.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(C=C(C#N)C#N)c3cccc4c5cccc6c(C=C(C#N)C#N)cc1c(c65)c2c34,CC#N,571.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(C=C(C#N)C#N)c3cccc4c5cccc6c(C=C(C#N)C#N)cc1c(c65)c2c34,Cc1ccccc1,584.0
CCCCCCCCCCCCC(CCCCCCCCCC)Cn1c2cc(C=C(C#N)C#N)c3cccc4c5cccc6c(C=C(C#N)C#N)cc1c(c65)c2c34,ClCCl,581.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,C1CCOC1,433.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,CC(C)=O,429.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,CCCCCC,419.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,CS(C)=O,437.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,Cc1ccccc1,429.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)ccc2-c2ccc(-c3ccc(C=C4C(=O)c5ccccc5C4=O)cc3)cc21,ClC(Cl)Cl,438.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(/C=C(/C#N)C(=O)O)sc2-c2sc(-c3ccc4c(c3)Sc3ccccc3N4CCCC)cc21,ClCCl,532.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(/C=C(/C#N)C(=O)O)sc2-c2sc(-c3ccc4c(c3)c3ccccc3n4CCCC)cc21,ClCCl,532.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc4c(c3)Sc3ccccc3N4CCCC)cc21,ClCCl,532.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3sc(-c4ccc(N(c5ccc(-c6ccc(OCCCCCC)cc6OCCCCCC)cc5)c5ccc(-c6ccc(OCCCCCC)cc6OCCCCCC)cc5)cc4)c4c3OCCO4)cc21,ClCCl,581.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3sc(-c4sc(-c5ccc(N(c6ccc(-c7ccc(OCCCCCC)cc7OCCCCCC)cc6)c6ccc(-c7ccc(OCCCCCC)cc7OCCCCCC)cc6)cc5)c5c4OCCO5)c4c3OCCO4)cc21,ClCCl,612.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(/C=C3/SC(=S)C(CC(=O)O)C3=O)sc2-c2sc(-c3ccc(N(c4ccc(-c5ccc(-c6ccc(OCCCCCC)cc6)s5)cc4)c4ccc(-c5ccc(-c6ccc(OCCCCCC)cc6)s5)cc4)cc3)cc21,ClC(Cl)Cl,565.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2cc(C=C(C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)cc21,ClC(Cl)Cl,552.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2ccccc2-c2cc3ccc(C=C4C(=O)C(C=C5C=Cc6cc(C(=O)O)ccc6N5C)=C4[O-])[n+](C)c3cc21,ClC(Cl)Cl,754.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2ccccc2-c2cc3ccc(C=C4C(=O)C(C=C5N(C)c6cc(C(=O)O)ccc6C5(C)C)=C4[O-])[n+](C)c3cc21,ClC(Cl)Cl,692.0
CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2ccccc2-c2cc3ccc(C=C4C(=O)C(C=C5N(C)c6cc7cc(C(=O)O)ccc7cc6C5(C)C)=C4[O-])[n+](C)c3cc21,ClC(Cl)Cl,715.0
CCCCCCCCCCCCCCCCCC(=O)Oc1cc2[nH]c(cc2CCOC)c2nc(ccc3[nH]c(cc3CCOC)c3nc1C(CCOC)=C3)C(CCOC)=C2,Cc1ccccc1,646.0
CCCCCCCCCCCCCCCCCCN1/C(=C\C=C2/SC(=S)N(CC(=O)O)C2=O)Sc2ccccc21,CCO,520.0
CCCCCCCCCCCCCCCCCCN1/C(=C\C=C\C=C2/SC(=S)N(CC(=O)O)C2=O)Sc2ccccc21,CCO,570.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCCCCCCCCCCCCCCCC)C5=O,CN(C)C=O,525.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)NC5=O,CN(C)C=O,523.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(OCCN(C)C)ccc(c23)C1=O,CC#N,363.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(OCCN(C)C)ccc(c23)C1=O,CC(C)=O,362.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(OCCN(C)C)ccc(c23)C1=O,CCO,362.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(OCCN(C)C)ccc(c23)C1=O,CCOC(C)=O,363.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(OCCN(C)C)ccc(c23)C1=O,CCOCC,359.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(OCCN(C)C)ccc(c23)C1=O,CN(C)C=O,364.0
CCCCCCCCCCCCCCCCCCN1C(=O)c2cccc3c(OCCN(C)C)ccc(c23)C1=O,ClCCl,363.0
CCCCCCCCCCCCCCCCCCOc1ccc(C#Cc2cc3nc4c(OCCCCCCCCCCCC)cc5c6cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc6c6cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc6c5c4nc3cc2C#Cc2ccc(OCCCCCCCCCCCCCCCCCC)cc2)cc1,ClC(Cl)Cl,487.0
CCCCCCCCCCCCCCCCCCOc1ccc([B-]23NC(c4ccccc4)=Nc4cccc([n+]42)N=C(c2ccccc2)N3)cc1,ClCCl,431.0
CCCCCCCCCCCCCCCCCCOc1ccccc1N1c2ccc(/C=c3\s/c(=C4/SC(=S)N(CCCCCCCC)C4=O)n(CC(=O)O)c3=O)cc2C2CCCC21,ClC(Cl)Cl,547.0
CCCCCCCCCCCCCCCCN(C)c1ccc(/C=C/c2cc[n+](CCCS(=O)(=O)[O-])cc2)cc1,CO,488.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,C1COCCO1,482.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CC(C)O,506.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CCCCCC,481.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CCCCCCCCO,498.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CCCCO,507.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CCCO,508.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CCO,508.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CO,509.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,CS(C)=O,486.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,Cc1ccc(C)cc1,483.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,Cc1ccccc1,483.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,ClC(Cl)Cl,514.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,ClCCl,516.0
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC)cc5)cc4)c3)cc2)cc1,c1ccccc1,484.0
CCCCCCCCCCCCCCCCOC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,334.0
CCCCCCCCCCCCCCCCOC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,334.0
CCCCCCCCCCCCCCCCOC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,332.0
CCCCCCCCCCCCCCCCOC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCOC(C)=O,334.0
CCCCCCCCCCCCCCCCOC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCCl,336.0
CCCCCCCCCCCCCCCCOC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1,c1ccccc1,334.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,Brc1ccccc1,442.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,C1CCCCC1,444.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,C1CCOC1,425.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,C1COCCO1,425.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,CCCCCC,442.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,CCCCCCCCO,431.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,CCCCOCCCC,435.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,CCOC(C)=O,426.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,CCOCC,429.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,Cc1ccccc1,436.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,ClC(Cl)(Cl)Cl,447.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,ClC(Cl)Cl,446.0
CCCCCCCCCCCCCCCCOc1cc(C#Cc2ccc3ccccc3c2-c2c(C#Cc3cc(OCCCCCCCCCCCCCCCC)c(C#Cc4ccc(C=C(C#N)C#N)cc4)cc3OCCCCCCCCCCCCCCCC)ccc3ccccc23)c(OCCCCCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C#N)cc1,ClCCl,436.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,C1COCCO1,387.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CC(C)=O,383.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CC(C)O,385.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CCCCCC,398.5
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CCCCO,390.5
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CCCO,398.5
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CCO,399.5
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CN(C)C=O,384.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CO,400.6
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,CS(C)=O,384.6
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,Cc1ccccc1,393.5
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,ClC(Cl)(Cl)Cl,399.5
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,ClC(Cl)Cl,384.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,ClCCl,386.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C(\C)c2ccccc2)cc1,c1ccccc1,386.8
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,C1COCCO1,354.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CC(C)=O,360.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CC(C)O,363.8
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CCCCCC,355.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CCCCO,364.8
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CCCO,364.7
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CCO,364.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CN(C)C=O,360.6
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CO,360.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,CS(C)=O,361.1
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,Cc1ccccc1,363.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,ClC(Cl)(Cl)Cl,359.1
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,ClC(Cl)Cl,370.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,ClCCl,376.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(C)cc2)cc1,c1ccccc1,360.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,C1COCCO1,463.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CC(C)=O,477.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CC(C)O,481.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CCCCCC,454.6
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CCCCO,487.1
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CCCO,485.6
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CCO,484.9
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CN(C)C=O,475.3
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CO,480.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,CS(C)=O,479.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,Cc1ccccc1,474.8
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,ClC(Cl)(Cl)Cl,467.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,493.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,ClCCl,515.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)cc2)cc1,c1ccccc1,476.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,C1COCCO1,558.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CC(C)=O,547.0
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CC(C)O,520.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CCCCCC,530.1
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CCCCO,523.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CCCO,518.9
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CCO,518.9
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CN(C)C=O,549.1
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CO,503.8
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,CS(C)=O,523.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,Cc1ccccc1,554.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,ClC(Cl)(Cl)Cl,548.4
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,ClC(Cl)Cl,554.2
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,ClCCl,553.8
CCCCCCCCCCCCCCCC[n+]1ccc(/C=C/c2ccccc2O)cc1,c1ccccc1,553.7
CCCCCCCCCCCCCCCCn1c(-c2cc(-c3nc4ccc(C)cc4n3CCCCCCCCCCCCCCCC)cc(-c3nc4ccc(C)cc4n3CCCCCCCCCCCCCCCC)c2)nc2ccc(C)cc21,ClCCl,306.0
CCCCCCCCCCCCCCCCn1c(-c2cc(-c3nc4ccccc4n3CCCCCCCCCCCCCCCC)cc(-c3nc4ccccc4n3CCCCCCCCCCCCCCCC)c2)nc2ccccc21,ClCCl,301.0
CCCCCCCCCCCCCCCc1c(-c2ccc(C=C(C#N)C(=O)O)s2)sc2c1sc1c3sc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c(CCCCCCCCCCCCCCC)c3sc21,Clc1ccccc1Cl,513.0
CCCCCCCCCCCCCCCc1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)sc2c1sc1c3sc(-c4ccc(C=C(C#N)C(=O)O)s4)c(CCCCCCCCCCCCCCC)c3sc21,Clc1ccccc1Cl,490.0
CCCCCCCCCCCCCCCc1c(C=C(C#N)C(=O)O)sc2c1sc1c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c(CCCCCCCCCCCCCCC)c3sc21,Clc1ccccc1Cl,498.0
CCCCCCCCCCCCCCOc1ccc(C#Cc2cc3nc4c(OCCCCCCCCCCCC)cc5c6cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc6c6cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc6c5c4nc3cc2C#Cc2ccc(OCCCCCCCCCCCCCC)cc2)cc1,ClC(Cl)Cl,486.0
CCCCCCCCCCCCCCn1c(-c2cc(-c3nc4ccc(C)cc4n3CCCCCCCCCCCCCC)cc(-c3nc4ccc(C)cc4n3CCCCCCCCCCCCCC)c2)nc2ccc(C)cc21,ClCCl,306.5
CCCCCCCCCCCCCCn1c(-c2cc(-c3nc4ccccc4n3CCCCCCCCCCCCCC)cc(-c3nc4ccccc4n3CCCCCCCCCCCCCC)c2)nc2ccccc21,ClCCl,298.0
CCCCCCCCCCCCCOc1ccc(N(c2ccc3c(c2)C(CCCC)(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2-3)c2ccc3c(c2)C(CCCC)(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2-3)cc1,ClCCCl,494.0
CCCCCCCCCCCCN(CCCCCCCCCCCC)c1ccc2c(c1)oc(=O)c1c(=O)oc3ccccc3c12,CS(C)=O,464.0
CCCCCCCCCCCCN(CCCCCCCCCCCC)c1ccc2c(c1)oc(=O)c1c(=O)oc3ccccc3c12,ClCCl,463.0
CCCCCCCCCCCCN(c1ccc(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)cc1)c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,ClCCl,472.0
CCCCCCCCCCCCN(c1ccc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)cc1)c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,ClCCl,463.0
CCCCCCCCCCCCN(c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1)c1ccc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)cc1,ClCCl,457.0
CCCCCCCCCCCCN1/C(=C/C2C(=C(C#N)C#N)C(=O)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,466.0
CCCCCCCCCCCCN1/C(=C/C2C(=O)/C(=C\c3cc(C(C)(C)C)[o+]c(C(C)(C)C)c3)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,ClC(Cl)Cl,688.0
CCCCCCCCCCCCN1/C(=C/C2C(=O)C(=O)C2O)C(C)(C)c2cc3ccccc3cc21,CCO,428.0
CCCCCCCCCCCCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,CCO,659.0
CCCCCCCCCCCCN1/C(=C\C2C(=O)C(=Cc3cc(C(C)(C)C)[s+]c(C(C)(C)C)c3)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,ClC(Cl)Cl,745.0
CCCCCCCCCCCCN1B2c3c4c(cc(-c5ccccc5)c5cccc1c54)cc1cc(-c4ccccc4)c4cccc(c4c31)N2CCCCCCCCCCCC,ClCCl,454.0
CCCCCCCCCCCCN1C(=O)c2c(c3ccc4cc(-c5ccc(-c6ccccc6)cc5)c(OC)cc4c3c3c2ccc2cc(-c4ccc(-c5ccccc5)cc4)c(OC)cc23)C1=O,ClCCl,437.0
CCCCCCCCCCCCN1C(=O)c2c(c3ccc4cc(-c5ccc(C#N)cc5)c(OC)cc4c3c3c2ccc2cc(-c4ccc(C#N)cc4)c(OC)cc23)C1=O,ClCCl,427.0
CCCCCCCCCCCCN1C(=O)c2c(c3ccc4cc(-c5ccc(C(F)(F)F)cc5)c(OC)cc4c3c3c2ccc2cc(-c4ccc(C(F)(F)F)cc4)c(OC)cc23)C1=O,ClCCl,427.0
CCCCCCCCCCCCN1C(=O)c2c(c3ccc4cc(-c5ccc(F)cc5)c(OC)cc4c3c3c2ccc2cc(-c4ccc(F)cc4)c(OC)cc23)C1=O,ClCCl,431.0
CCCCCCCCCCCCN1C(=O)c2c(c3ccc4cc(-c5ccc(N(C)C)cc5)c(OC)cc4c3c3c2ccc2cc(-c4ccc(N(C)C)cc4)c(OC)cc23)C1=O,ClCCl,477.0
CCCCCCCCCCCCN1C(=O)c2c(c3ccc4cc(-c5ccc(OC)cc5)c(OC)cc4c3c3c2ccc2cc(-c4ccc(OC)cc4)c(OC)cc23)C1=O,ClCCl,443.0
CCCCCCCCCCCCN1C(=O)c2c(c3ccc4cc(-c5cccs5)c(OC)cc4c3c3c2ccc2cc(-c4cccs4)c(OC)cc23)C1=O,ClCCl,452.0
CCCCCCCCCCCCN1C(=O)c2ccc3c4c(-c5ccc(C(F)(F)F)cc5)cc5c6c(ccc(c7c(-c8ccc(C(F)(F)F)cc8)cc(c2c37)C1=O)c64)C(=O)N(CCCCCCCCCCCC)C5=O,ClC(Cl)Cl,523.6486486486486
CCCCCCCCCCCCN1C(=O)c2ccc3c4c(-c5cccc([N+](=O)[O-])c5)cc5c6c(ccc(c7c(-c8cccc([N+](=O)[O-])c8)cc(c2c37)C1=O)c64)C(=O)N(CCCCCCCCCCCC)C5=O,ClC(Cl)Cl,543.3829973707275
CCCCCCCCCCCCN1C(=O)c2ccc3c4c(Br)cc5c6c(ccc(c7c(Br)cc(c2c37)C1=O)c64)C(=O)N(CCCCCCCCCCCC)C5=O,ClC(Cl)Cl,525.2011859381618
CCCCCCCCCCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)NC5=O,CN(C)C=O,522.0
CCCCCCCCCCCCN1C(=O)c2cccc3c(N(Cc4ccccn4)Cc4ccccn4)c4ccccc4c(c23)C1=O,C1CCOC1,497.0
CCCCCCCCCCCCN1C(=O)c2cccc3c(N(Cc4ccccn4)Cc4ccccn4)c4ccccc4c(c23)C1=O,CCCCCC,480.0
CCCCCCCCCCCCN1C(=O)c2cccc3c(N(Cc4ccccn4)Cc4ccccn4)c4ccccc4c(c23)C1=O,CCO,488.0
CCCCCCCCCCCCN1C(=O)c2cccc3c(N(Cc4ccccn4)Cc4ccccn4)c4ccccc4c(c23)C1=O,Cc1ccccc1,492.0
CCCCCCCCCCCCN1C(=O)c2cccc3c(N(Cc4ccccn4)Cc4ccccn4)c4ccccc4c(c23)C1=O,ClCCl,500.0
CCCCCCCCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(-c4ccc5c(c4)Sc4cc(/C=C(\C#N)C(=O)O)ccc4N5CCCCCCCCCCCC)c4nsnc34)ccc21,CN(C)C=O,471.0
CCCCCCCCCCCCN1c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,517.0
CCCCCCCCCCCCN1c2ccccc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,491.0
CCCCCCCCCCCCN1c2ccccc2Sc2cc(-c3ccc(-c4ccc5c(c4)Sc4cc(/C=C(\C#N)C(=O)O)ccc4N5CCCCCCCCCCCC)c4nn(CCCCCCCC)nc34)ccc21,CCO,474.0
CCCCCCCCCCCCN1c2ccccc2Sc2cc(-c3ccc(-c4ccc5c(c4)Sc4cc(/C=C(\C#N)C(=O)O)ccc4N5CCCCCCCCCCCC)c4nsnc34)ccc21,CCO,486.0
CCCCCCCCCCCCN1c2ccccc2Sc2cc(-c3cccc(-c4ccc5c(c4)Sc4cc(/C=C(\C#N)C(=O)O)ccc4N5CCCCCCCCCCCC)n3)ccc21,CCO,472.0
CCCCCCCCCCCCNc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,C1CCOC1,498.0
CCCCCCCCCCCCNc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,CC#N,493.0
CCCCCCCCCCCCNc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,CCCCCC,496.0
CCCCCCCCCCCCNc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,Cc1ccccc1,500.0
CCCCCCCCCCCCOc1cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C=C2/C=CC(=N2)/C=4c2cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c2)cc(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC,C1CCOC1,616.0
CCCCCCCCCCCCOc1cc(/C=C/c2ccc3c(c2)C(CC)(CC)c2cc(N4c5ccccc5Sc5ccccc54)ccc2-3)c(OCCCCCCCCCCCC)cc1/C=C/c1ccc2c(c1)C(CC)(CC)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,C1CCOC1,442.4137931
CCCCCCCCCCCCOc1cc(/C=C/c2ccc3c(c2)C(CC)(CC)c2cc(N4c5ccccc5Sc5ccccc54)ccc2-3)c(OCCCCCCCCCCCC)cc1/C=C/c1ccc2c(c1)C(CC)(CC)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,CC#N,436.7241379
CCCCCCCCCCCCOc1cc(/C=C/c2ccc3c(c2)C(CC)(CC)c2cc(N4c5ccccc5Sc5ccccc54)ccc2-3)c(OCCCCCCCCCCCC)cc1/C=C/c1ccc2c(c1)C(CC)(CC)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,CCCCCC,436.3793103
CCCCCCCCCCCCOc1cc(/C=C/c2ccc3c(c2)C(CC)(CC)c2cc(N4c5ccccc5Sc5ccccc54)ccc2-3)c(OCCCCCCCCCCCC)cc1/C=C/c1ccc2c(c1)C(CC)(CC)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,Cc1ccccc1,442.9310345
CCCCCCCCCCCCOc1cc(/C=C/c2ccc3c(c2)C(CC)(CC)c2cc(N4c5ccccc5Sc5ccccc54)ccc2-3)c(OCCCCCCCCCCCC)cc1/C=C/c1ccc2c(c1)C(CC)(CC)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,ClCCl,420.0
CCCCCCCCCCCCOc1cc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c(OCCCCCCCCCCCC)cc1C#Cc1ccc(C(=O)O)cc1,C1CCOC1,393.0
CCCCCCCCCCCCOc1cc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c(OCCCCCCCCCCCC)cc1C#Cc1ccc(C=C(C#N)C(=O)O)cc1,C1CCOC1,407.0
CCCCCCCCCCCCOc1cc(C(=O)Nc2ccc(-c3ccc4c(c3)C(=O)c3cc(-c5ccc(NC(=O)c6cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c6)cc5)ccc3-4)cc2)cc(OCCCCCCCCCCCC)c1OCCCCCCCCCCCC,C1CCOC1,447.0
CCCCCCCCCCCCOc1cc(OCCCCCCCCCCCC)cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc(N(C)C)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(-c3ccc(C(=O)O)cc3)c3nsnc23)=C2/C=CC(=N2)/C=4c2c(OCCCCCCCCCCCC)cccc2OCCCCCCCCCCCC)c1,C1CCOC1,689.0
CCCCCCCCCCCCOc1cc(OCCCCCCCCCCCC)cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc(N(C)C)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(-c3ccc(C(=O)O)cc3)s2)=C2/C=CC(=N2)/C=4c2c(OCCCCCCCCCCCC)cccc2OCCCCCCCCCCCC)c1,C1CCOC1,674.0
CCCCCCCCCCCCOc1cc2c(cc1OCCCCCCCCCCCC)C1=C3C(=O)N4C=Cc5cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc5C4=C3C(=O)N1C=C2,CN(C)C=O,592.0
CCCCCCCCCCCCOc1cc2c(cc1OCCCCCCCCCCCC)C1=C3C(=O)N4C=Cc5cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc5C4=C3C(=O)N1C=C2,ClC(Cl)Cl,590.0
CCCCCCCCCCCCOc1cc2c3c(ccc4c5c(N6CCOCC6)cc6c7c(ccc(c1c34)c75)C(=O)N(C1CCCCC1)C6=O)C(=O)N(C1CCCCC1)C2=O,ClC(Cl)Cl,606.0
CCCCCCCCCCCCOc1cc2c3c(ccc4c5c(NC6CCCCC6)cc6c7c(ccc(c1c34)c75)C(=O)N(C1CCCCC1)C6=O)C(=O)N(C1CCCCC1)C2=O,ClC(Cl)Cl,640.0
CCCCCCCCCCCCOc1cc2c3c(ccc4c5c(OCCCCCCCCCCCC)cc6c7c(ccc(c1c34)c75)C(=O)N(C1CCCCC1)C6=O)C(=O)N(C1CCCCC1)C2=O,ClC(Cl)Cl,570.0
CCCCCCCCCCCCOc1cc2c3c(ccc4c5c(SCCCCCCCCCCCC)cc6c7c(ccc(c1c34)c75)C(=O)N(C1CCCCC1)C6=O)C(=O)N(C1CCCCC1)C2=O,ClC(Cl)Cl,568.0
CCCCCCCCCCCCOc1cc2c3cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc3c3c(cc(OCCCCCCCCCCCC)c4nc5cc(C#Cc6ccc(CCCCCCCCCC)cc6)c(C#Cc6ccc(CCCCCCCCCC)cc6)cc5nc43)c2cc1OCCCCCCCCCCCC,ClC(Cl)Cl,482.0
CCCCCCCCCCCCOc1cc2c3cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc3c3c(cc(OCCCCCCCCCCCC)c4nc5cc(C#Cc6ccc(OCCC(C)CCCC(C)C)cc6)c(C#Cc6ccc(OCCC(C)CCCC(C)C)cc6)cc5nc43)c2cc1OCCCCCCCCCCCC,ClC(Cl)Cl,485.0
CCCCCCCCCCCCOc1cc2c3cc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)cc3c3c(cc(OCCCCCCCCCCCC)c4nc5cc(C#Cc6ccc(OCCCC)cc6)c(C#Cc6ccc(OCCCC)cc6)cc5nc43)c2cc1OCCCCCCCCCCCC,ClC(Cl)Cl,485.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,C1CCOC1,361.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,CC#N,368.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,CCCCCC,336.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,CCO,368.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,CCOC(C)=O,361.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,CS(C)=O,369.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,ClCCl,368.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C#N,O,368.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,C1CCOC1,476.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,CC#N,477.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,CCCCCC,432.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,CCO,487.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,CCOC(C)=O,469.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,CS(C)=O,487.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,ClCCl,487.0
CCCCCCCCCCCCOc1cc2cc(N(C)C)ccc2cc1C=C(C#N)C#N,O,476.0
CCCCCCCCCCCCOc1ccc(-c2nc3c(-c4cc5c(s4)-c4sc(/C=C(\C#N)C(=O)O)cc4[Si]5(CC(CC)CCCC)CC(CC)CCCC)cnc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)c3nc2-c2ccc(OCCCCCCCCCCCC)cc2)cc1,ClCCl,562.0
CCCCCCCCCCCCOc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(N(CCCCCCCCCCCC)CCCCCCCCCCCC)cc2)=C2/C=CC(=N2)/C=4c2ccc(OCCCCCCCCCCCC)cc2)cc1,ClCCl,640.0
CCCCCCCCCCCCOc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C(=C(C#N)C#N)C(=C(C#N)C#N)c2ccc(N(CCCCCCCCCCCC)CCCCCCCCCCCC)cc2)=C2/C=CC(=N2)/C=4c2ccc(OCCCCCCCCCCCC)cc2)cc1,ClCCl,610.0
CCCCCCCCCCCCOc1ccc(/C=N/c2ccc3[nH]c(OCCCCCC)nc3c2)c(O)c1,ClC(Cl)Cl,360.0
CCCCCCCCCCCCOc1ccc(/C=N/c2ccc3[nH]c(OCCCCCCCCCCCC)nc3c2)c(O)c1,ClC(Cl)Cl,360.0
CCCCCCCCCCCCOc1ccc(C#CC(C#Cc2ccc(OCCCCCCCCCCCC)cc2)=Cc2cc(C=C(C#Cc3ccc(OCCCCCCCCCCCC)cc3)C#Cc3ccc(OCCCCCCCCCCCC)cc3)cc(C=C(C#Cc3ccc(OCCCCCCCCCCCC)cc3)C#Cc3ccc(OCCCCCCCCCCCC)cc3)c2)cc1,CCOC(C)=O,347.0
CCCCCCCCCCCCOc1ccc(C#CC(C#Cc2ccc(OCCCCCCCCCCCC)cc2)=Cc2ccc(C=C(C#Cc3ccc(OCCCCCCCCCCCC)cc3)C#Cc3ccc(OCCCCCCCCCCCC)cc3)cc2)cc1,CCOC(C)=O,428.0
CCCCCCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCCCCCC,C1CCOC1,461.0
CCCCCCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCCCCCC,Cc1ccccc1,461.0
CCCCCCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCCCCCC,ClCCl,461.0
CCCCCCCCCCCCOc1ccc(C2=C3C(=O)N(CC(OCC)OCC)C(c4ccc(OCCCCCCCCCCCC)c(OCCCCCCCCCCCC)c4)=C3C(=O)N2CC(OCC)OCC)cc1OCCCCCCCCCCCC,ClC(Cl)Cl,496.0
CCCCCCCCCCCCOc1ccc(C2=c3sc4ccccc4c3=[N+]3C2=Nc2c(-c4ccc(OCCCCCCCCCCCC)cc4)c4sc5ccccc5c4n2[B-]3(F)F)cc1,C1CCOC1,729.0
CCCCCCCCCCCCOc1ccc(C2=c3sc4ccccc4c3=[N+]3C2=Nc2c(-c4ccc(OCCCCCCCCCCCC)cc4)c4sc5ccccc5c4n2[B-]3(F)F)cc1,Cc1ccccc1,733.0
CCCCCCCCCCCCOc1ccc(C2=c3sc4ccccc4c3=[N+]3C2=Nc2c(-c4ccc(OCCCCCCCCCCCC)cc4)c4sc5ccccc5c4n2[B-]3(F)F)cc1,ClC(Cl)Cl,731.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#CC(=O)O)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(N(C)C)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,667.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2c(OCCCCCCC)c(OCCCCCCC)c(-c3ccc(C(=O)O)cc3)c3nsnc23)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc2c(c1)Sc1cc(-c4ccc(OCCCCCC)cc4)ccc1N2CCCCCC)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,678.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2c3ccccc3c(C#Cc3ccc(N(CCCCCCCC)CCCCCCCC)cc3)c3ccccc23)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(-c2ccc(C(=O)O)cc2)c2nsnc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,709.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2c3ccccc3c(C#Cc3ccc4ccc5cccc6ccc3c4c56)c3ccccc23)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,690.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2c3ccccc3c(N(CCCCCCCC)CCCCCCCC)c3ccccc23)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(-c2ccc(C(=O)O)cc2)c2nsnc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,694.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2c3ccccc3c(N(c3ccc(CCCCCCCC)cc3)c3ccc(CCCCCCCC)cc3)c3ccccc23)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(-c2ccc(C(=O)O)cc2)c2nsnc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,696.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)c(C#N)c2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccc(-n2c4ccccc4c4ccccc42)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,627.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1c2ccccc2c(C#CN(CCCCCCCC)CCCCCCCC)c2ccccc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,691.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(N(CCCCCCCC)CCCCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,671.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)s2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(N(C)C)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,671.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(C)C)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1c2ccccc2c(C#Cc2ccc(C(=O)O)cc2)c2ccccc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,697.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(C)C)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,667.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccnc(C(=O)O)c1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,650.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccnc(O)c1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,643.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccncc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,643.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1/C1=C2\C=CC(=N2)/C=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,619.0
CCCCCCCCCCCCOc1cccc(OCCCCCCCCCCCC)c1C1=C2C=CC(=N2)C(C#Cc2ccc(C(=O)O)cc2)=c2ccc3n2[Zn]n2c(ccc21)C(c1ccc(-n2c4ccccc4c4ccccc42)cc1)=C1C=CC(=N1)C=3c1c(OCCCCCCCCCCCC)cccc1OCCCCCCCCCCCC,C1CCOC1,446.0
CCCCCCCCCCCCOc1ccccc1N1c2ccc(/C=c3\s/c(=C4/SC(=S)N(CCCCCCCC)C4=O)n(CC(=O)O)c3=O)cc2C2CCCC21,ClC(Cl)Cl,547.0
CCCCCCCCCCCCOc1nc2cc(/N=C/c3ccc(OCCCCCCCC)cc3O)ccc2[nH]1,ClC(Cl)Cl,360.0
CCCCCCCCCCCCSc1cc2c3c(ccc4c5c(SCCCCCCCCCCCC)cc6c7c(ccc(c1c34)c75)C(=O)N(C1CCCCC1)C6=O)C(=O)N(C1CCCCC1)C2=O,ClC(Cl)Cl,574.0
CCCCCCCCCCCC[C@@H](CCCCCCCCCC)CN1c2ccc(/C=C3/SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(N3c4ccccc4Sc4ccccc43)ccc21,ClCCl,472.0
CCCCCCCCCCCC[C@@H](CCCCCCCCCC)CN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccccc4c4ccccc43)ccc21,ClCCl,478.0
CCCCCCCCCCCC[C@@H](CCCCCCCCCC)CN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(N3CCCC3)ccc21,ClCCl,536.0
CCCCCCCCCCCC[C@@H](CCCCCCCCCC)CN1c2ccc(Br)cc2Sc2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc21,ClCCl,473.0
CCCCCCCCCCCC[C@@H](CCCCCCCCCC)CN1c2ccc(C#N)cc2Sc2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc21,ClCCl,462.0
CCCCCCCCCCCC[C@@H](CCCCCCCCCC)CN1c2ccccc2Sc2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc21,ClCCl,478.0
CCCCCCCCCCCC[N+]1=C(/C=C2/C(=O)C(/C=C3\N(C)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4C3(C)C)=C2[O-])[C@@](CCCCCCCC)(CCCCCCCCCC)c2ccccc21,ClC(Cl)Cl,665.0
CCCCCCCCCCCC[N+]1=C(/C=C2/C(=O)C(/C=C3\N(C)c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4C3(C)C)=C2[O-])C(CCCCCCCC)(CCCCCCCCCC)c2ccccc21,ClC(Cl)Cl,665.0
CCCCCCCCCCCC[N+]1=C(CC2=C([O-])C(=O)/C2=C(\C#N)C(=O)OCC)C(C)(C)c2ccccc21,CC#N,465.0
CCCCCCCCCCCC[NH+]1/C(=C/C2=C([O-])/C(=C\C3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc21,CCO,659.0
CCCCCCCCCCCCc1cc(-c2cc3sc4cc(-c5cc(CCCCCCCCCCCC)c(-c6ccc(N(c7ccccc7)c7ccc(/C=C(\C#N)C(=O)O)cc7)cc6)s5)sc4c3s2)sc1-c1ccc(N(c2ccccc2)c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,C1CCOC1,438.0
CCCCCCCCCCCCc1cc(-c2cc3sc4cc(-c5cc(CCCCCCCCCCCC)c(-c6ccc(N(c7ccccc7)c7ccc(/C=C(\C#N)C(=O)O)cc7)cc6)s5)sc4c3s2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,434.0
CCCCCCCCCCCCc1cc(-c2ccc(-c3cc(CCCCCCCCCCCC)c(-c4ccc(N(c5ccccc5)c5ccc(/C=C(\C#N)C(=O)O)cc5)cc4)s3)c3nsnc23)sc1-c1ccc(N(c2ccccc2)c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,C1CCOC1,432.0
CCCCCCCCCCCCc1cc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,343.0
CCCCCCCCCCCCc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)sc1-c1cc2sc(/C=C(\C#N)C(=O)O)cc2s1,ClCCl,489.0
CCCCCCCCCCCCc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)sc1-c1ccc(/C=C(\C#N)C(=O)O)s1,ClCCl,493.0
CCCCCCCCCCCCc1cc(-c2ccc(N3c4ccc(-c5ccc(OC)cc5)cc4C4C5CCC(C5)C43)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,498.0
CCCCCCCCCCCCc1cc(-c2ccc(N3c4ccc(-c5cccs5)cc4C4C5CCC(C5)C43)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,501.0
CCCCCCCCCCCCc1cc(-c2ccc(N3c4ccc(C=C(c5ccccc5)c5ccccc5)cc4C4C5CCC(C5)C43)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,489.0
CCCCCCCCCCCCc1cc(-c2ccc(N3c4ccccc4C4C5CCC(C5)C43)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,500.0
CCCCCCCCCCCCc1cc(-c2ccc(N3c4ccccc4C4C5CCC(C5)C43)cc2)sc1-c1ccc(/C=C(/C#N)C(=O)O)cc1,ClCCl,452.0
CCCCCCCCCCCCc1cc(-c2ccc(N3c4ccccc4C4C5CCC(C5)C43)cc2)sc1-c1ccc(/C=C(\C#N)C(=O)O)s1,ClCCl,506.0
CCCCCCCCCCCCc1cc(-c2ccc3c(c2)C2C4CCC(C4)C2N3c2ccc(-c3ccc(OC)cc3)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,520.0
CCCCCCCCCCCCc1cc(-c2ccc3c(c2)C2C4CCC(C4)C2N3c2ccc(-c3cccs3)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,520.0
CCCCCCCCCCCCc1cc(-c2ccc3c(c2)C2C4CCC(C4)C2N3c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,516.0
CCCCCCCCCCCCc1cc(-c2ccc3c(c2)N(c2ccccc2)C2C4CCC(C4)C32)sc1-c1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)s1,ClCCl,542.0
CCCCCCCCCCCCc1cc(C#Cc2c3ccccc3c(C#Cc3ccc(N(CCCCCCCC)CCCCCCCC)cc3)c3ccccc23)c(CCCCCCCCCCCC)cc1C#Cc1ccc(C(=O)O)cc1,C1CCOC1,504.0
CCCCCCCCCCCCc1ccc2c(c1)c1cc(CCCCCCCCCCCC)ccc1c1nc3c(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)ncc(-c4cc5c(s4)-c4sc(/C=C(\C#N)C(=O)O)cc4[Si]5(CC(CC)CCCC)CC(CC)CCCC)c3nc21,ClCCl,593.0
CCCCCCCCCCCCc1sc(CCCCCC)c2c3cc(CCCCCC)sc3c3sc(CCCCCC)cc3c12,ClC(Cl)Cl,373.0
CCCCCCCCCCCCc1sc(CCCCCCCCCCCC)c2c3ccsc3c3sccc3c12,ClC(Cl)Cl,383.0
CCCCCCCCCCCCn1c(-c2cc(-c3nc4ccc(C)cc4n3CCCCCCCCCCCC)cc(-c3nc4ccc(C)cc4n3CCCCCCCCCCCC)c2)nc2ccc(C)cc21,ClCCl,306.5
CCCCCCCCCCCCn1c(-c2cc(-c3nc4ccccc4n3CCCCCCCCCCCC)cc(-c3nc4ccccc4n3CCCCCCCCCCCC)c2)nc2ccccc21,ClCCl,299.5
CCCCCCCCCCCCn1c(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClC(Cl)Cl,426.0
CCCCCCCCCCCCn1c(-c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)s2)cc2cc(-c3ccc(/C=C4/SC(=S)N(CC(=O)O)C4=O)s3)ccc21,ClC(Cl)Cl,390.0
CCCCCCCCCCCCn1c(-c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)s2)cc2cc(-c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)s3)ccc21,ClC(Cl)Cl,390.0
CCCCCCCCCCCCn1c(C=C(C#N)C(=O)O)ccc1-c1ccc(-c2ccc(-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)s2)c2nsnc12,ClCCl,517.0
CCCCCCCCCCCCn1c2c(c3ccccc31)C(Cc1c(OCC)c(=O)c1=O)C=CN2C,CC#N,515.0
CCCCCCCCCCCCn1c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)s4)s3)cc2c2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,416.0
CCCCCCCCCCCCn1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2c2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,457.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,C1COCCO1,393.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CC#N,391.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CCO,400.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CCOC(C)=O,390.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CO,400.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CS(C)=O,402.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,Cc1ccccc1,399.0
CCCCCCCCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,ClC(Cl)Cl,404.0
CCCCCCCCCCCCn1cccc1/C=C/c1cc(OCCCC)c(/C=C/c2cccn2CCCCCCCCCCCC)cc1OCCCC,Cc1ccccc1,411.0
CCCCCCCCCCCCn1cccc1/C=C/c1ccc(/C=C/c2cccn2CCCCCCCCCCCC)cc1,Cc1ccccc1,398.0
CCCCCCCCCCCCn1cccc1/C=C/c1ccc(OCCCC)c2c(/C=C/c3cccn3CCCCCCCCCCCC)ccc(OCCCC)c12,Cc1ccccc1,375.0
CCCCCCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,C1CCOC1,428.0
CCCCCCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,Cc1ccccc1,428.0
CCCCCCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,ClCCl,428.0
CCCCCCCCCCCn1cccc1C1=[N+]2C(=Cc3c(C)cc(C)n3[B-]2(F)F)c2ccccc21,C1CCOC1,584.0
CCCCCCCCCCCn1cccc1C1=[N+]2C(=Cc3c(C)cc(C)n3[B-]2(F)F)c2ccccc21,CC#N,577.0
CCCCCCCCCCCn1cccc1C1=[N+]2C(=Cc3c(C)cc(C)n3[B-]2(F)F)c2ccccc21,CCCCCC,583.0
CCCCCCCCCCCn1cccc1C1=[N+]2C(=Cc3c(C)cc(C)n3[B-]2(F)F)c2ccccc21,CO,579.0
CCCCCCCCCCCn1cccc1C1=[N+]2C(=Cc3c(C)cc(C)n3[B-]2(F)F)c2ccccc21,Cc1ccccc1,590.0
CCCCCCCCCCCn1cccc1C1=[N+]2C(=Cc3c(C)cc(C)n3[B-]2(F)F)c2ccccc21,ClCCl,584.0
CCCCCCCCCCN1/C(=C\C=C2/SC(=S)N(CC(=O)O)C2=O)Sc2ccccc21,CCO,520.0
CCCCCCCCCCN1C(=O)c2cc(NCCCOCCO)c3c4c(cc(NCCCOCCO)c(c24)C1=O)C(=O)N(CCCCCCCCCC)C3=O,CO,604.0
CCCCCCCCCCN1C(=O)c2cc(NCCCOCCO)c3c4c(cc(NCCCOCCO)c(c24)C1=O)C(=O)N(CCCCCCCCCC)C3=O,ClC(Cl)Cl,609.0
CCCCCCCCCCN1c2ccccc2Sc2cc(-c3nc4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4s3)ccc21,CN(C)C=O,405.0
CCCCCCCCCCOc1cc(OCCCCCCCCCC)cc(C2=C3C(/C=C/c4ccc(N(C)C)cc4)=C(C#Cc4ccc(C(C)(C)C)cc4)C(/C=C/c4ccc(N(C)C)cc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccc(N(C)C)cc4)c(C#Cc4ccc(C(C)(C)C)cc4)c(/C=C/c4ccc(N(C)C)cc4)c32)c1,ClC(Cl)Cl,797.0
CCCCCCCCCCOc1cc(OCCCCCCCCCC)cc(C2=C3C(/C=C/c4ccc(OC)cc4)=C(C#Cc4ccc(C(C)(C)C)cc4)C(/C=C/c4ccc(OC)cc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccc(OC)cc4)c(C#Cc4ccc(C(C)(C)C)cc4)c(/C=C/c4ccc(OC)cc4)c32)c1,ClC(Cl)Cl,732.0
CCCCCCCCCCOc1cc(OCCCCCCCCCC)cc(C2=C3C(/C=C/c4ccc(OC)cc4)=CC(/C=C/c4ccc(OC)cc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccc(OC)cc4)cc(C=Cc4ccc(OC)cc4)c32)c1,ClC(Cl)Cl,689.0
CCCCCCCCCCOc1cc(OCCCCCCCCCC)cc(C2=C3C(C)=CC(/C=C/c4ccc(OC)cc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccc(OC)cc4)cc(C)c32)c1,ClC(Cl)Cl,645.0
CCCCCCCCCCOc1cc(OCCCCCCCCCC)cc(C2=C3C(C)=CC(/C=C/c4ccc(OC)cc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccc(OC)cc4)cc(C=Cc4ccc(OC)cc4)c32)c1,ClC(Cl)Cl,665.0
CCCCCCCCCCOc1cc2c(cc1OCCCCCCCCCC)c1sc(-c3cc4c5cc(C=C(C#N)C(=O)O)sc5c5ccccc5c4s3)cc1c1cc(-c3ccc4c(c3)C(CCCC)(CCCC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)sc12,C1CCOC1,509.0
CCCCCCCCCCOc1cc2c(cc1OCCCCCCCCCC)c1sc(-c3ccc4c(c3)C(CCCC)(CCCC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)cc1c1cc(C=C(C#N)C(=O)O)sc12,C1CCOC1,493.0
CCCCCCCCCCOc1cc2c(cc1OCCCCCCCCCC)c1sc(-c3ccc4c(c3)c3ccccc3n4CCCCCCCCCC)cc1c1cc(C=C(C#N)C(=O)O)sc12,C1CCOC1,483.0
CCCCCCCCCCOc1cc2cc(C#Cc3ccc(/C=C(\C#N)C(=O)O)cc3)c(=O)oc2cc1OCCCCCCCCCC,CC#N,398.0
CCCCCCCCCCOc1ccc(C#Cc2cc3c(C#Cc4ccc(OCCCCCCCCCC)cc4)c(C#Cc4ccc(OCCCCCCCCCC)cc4)c4cc(C#Cc5ccc(OCCCCCCCCCC)cc5)cc5c(C#Cc6ccc(OCCCCCCCCCC)cc6)c(C#Cc6ccc(OCCCCCCCCCC)cc6)c(c2)c3c45)cc1,ClCCl,421.0
CCCCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCCCC)c(OCCCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCCCC,C1CCOC1,461.0
CCCCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCCCC)c(OCCCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCCCC,Cc1ccccc1,461.0
CCCCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCCCC)c(OCCCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCCCC,ClCCl,461.0
CCCCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,ClCCl,504.0
CCCCCCCCCCOc1ccc2c3c(oc2c1)C1=C2C(=O)N4C=Cc5c(oc6cc(OCCCCCCCCCC)ccc56)C4=C2C(=O)N1C=C3,CN(C)C=O,648.0
CCCCCCCCCCOc1ccc2c3c(oc2c1)C1=C2C(=O)N4C=Cc5c(oc6cc(OCCCCCCCCCC)ccc56)C4=C2C(=O)N1C=C3,ClC(Cl)Cl,648.0
CCCCCCCCCCOc1ccc2cc(C3=C4C(=O)N(CC(OCC)OCC)C(c5cc6ccc(OCCCCCCCCCC)cc6o5)=C4C(=O)N3CC(OCC)OCC)oc2c1,ClC(Cl)Cl,595.0
CCCCCCCCCC[C@@]1(CCCCCCCC)/C(=C\C2=C([O-])/C(=C\C3=[N+](C)c4ccccc4C3(C)C)C2=O)N(CCCCCC)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,ClC(Cl)Cl,667.0
CCCCCCCCCC[C@@]1(CCCCCCCC)/C(=C\C2=C([O-])/C(=C\C3=[N+](C)c4ccccc4C3(C)C)C2=O)N(CCCCCCC)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc21,ClC(Cl)Cl,654.0
CCCCCCCCCC[C@@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3/N(C)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4C3(C)C)=C2[O-])=[N+](CCCCCC)c2ccccc21,ClC(Cl)Cl,665.0
CCCCCCCCCC[C@@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3/N(C)c4ccc(C(=O)O)cc4C3(C)C)=C2[O-])=[N+](C)c2cc3c(cc21)-c1ccccc1C3(CCCCCCCC)CCCCCCCC,ClCCl,665.0
CCCCCCCCCC[C@@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3/N(C)c4ccc(C(=O)O)cc4C3(C)C)=C2[O-])=[N+](CCCCCC)c2cc3c(cc21)-c1ccccc1C3(CCCCCCCC)CCCCCCCC,ClCCl,666.0
CCCCCCCCCC[C@@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3/N(C)c4ccc5cc(C(=O)O)ccc5c4C3(C)C)=C2[O-])=[N+](C)c2cc3c(cc21)-c1ccccc1C3(CCCCCCCC)CCCCCCCC,ClCCl,679.0
CCCCCCCCCC[C@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3/N(C)c4ccc(C(=O)O)cc4C3(C)C)=C2[O-])=[N+](C)c2cc3c(cc21)-c1ccccc1C3(CCCCCCCC)CCCCCCCC,ClCCl,665.0
CCCCCCCCCC[C@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3/N(C)c4ccc(C(=O)O)cc4C3(C)C)=C2[O-])=[N+](CCCCCC)c2cc3c(cc21)-c1ccccc1C3(CCCCCCCC)CCCCCCCC,ClCCl,666.0
CCCCCCCCCC[C@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3/N(C)c4ccc5cc(C(=O)O)ccc5c4C3(C)C)=C2[O-])=[N+](C)c2cc3c(cc21)-c1ccccc1C3(CCCCCCCC)CCCCCCCC,ClCCl,679.0
CCCCCCCCCC[C@]1(CCCCCCCC)C(/C=C2/C(=O)C(/C=C3\N(C)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)cc4C3(C)C)=C2[O-])=[N+](CCCCCC)c2ccccc21,ClC(Cl)Cl,654.0
CCCCCCCCCC[N+]1=C(/C=C2\C([O-])=C(/C=C3/N(CCCC)c4ccc5ccccc5c4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2cc(-c3cc4sc(/C=C(\C#N)C(=O)O)cc4s3)ccc21,ClC(Cl)Cl,720.0
CCCCCCCCCC[n+]1cc2ccc3c[n+](CCCCCCCCCC)cc4ccc(c1)c2c34,CC#N,418.0
CCCCCCCCCCc1cc(-c2cc(CCCCCCCCCC)c(-c3cccs3)s2)sc1-c1cccs1,CCCCCCCCCCCCCC,380.0
CCCCCCCCCCc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,429.0
CCCCCCCCCCc1csc(-c2nc(CCCCCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)n1,C1CCOC1,413.0
CCCCCCCCCCc1csc(/C=N/c2sc(/N=C/c3cc(CCCCCCCCCC)cs3)c(C(=O)OCC)c2C(=O)OCC)c1,CC#N,440.0
CCCCCCCCCCc1nc(-c2nc(CCCCCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1,C1CCOC1,432.0
CCCCCCCCCCc1nc(-c2nc(CCCCCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1ccc2c3ccccc3n(CCCC)c2c1,C1CCOC1,428.0
CCCCCCCCCCc1nc(-c2nc(CCCCCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1cccs1,C1CCOC1,425.0
CCCCCCCCCCn1c(-c2cc(-c3nc4ccc(C)cc4n3CCCCCCCCCC)cc(-c3nc4ccc(C)cc4n3CCCCCCCCCC)c2)nc2ccc(C)cc21,ClCCl,307.5
CCCCCCCCCCn1c(-c2cc(-c3nc4ccccc4n3CCCCCCCCCC)cc(-c3nc4ccccc4n3CCCCCCCCCC)c2)nc2ccccc21,ClCCl,299.5
CCCCCCCCCCn1c(C=C(C#N)C(=O)O)ccc1-c1ccc(-c2ccc(-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)s2)c2nsnc12,ClCCl,517.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,C1CCCCC1,462.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,C1CCOC1,471.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,CC#N,470.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,CC(C)OC(C)C,470.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,CCCCOCCCC,469.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,CCO,480.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,CCOC(C)=O,472.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,CN(C)C=O,474.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,Cc1ccccc1,472.0
CCCCCCCCCCn1cc(C2=C(c3cn(CCCCCCCCCC)c4ccccc34)C(=O)N(C)C2=O)c2ccccc21,ClCCl,477.0
CCCCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,C1CCOC1,428.0
CCCCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,Cc1ccccc1,428.0
CCCCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,ClCCl,428.0
CCCCCCCCCN(/N=C/c1ccc(N(c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2ccc(CCCCCC)cc2)cc1)c1ccccc1,ClC(Cl)Cl,500.0
CCCCCCCCCN(/N=C/c1ccc(N(c2ccc(C)cc2)c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)cc1)c1ccccc1,ClC(Cl)Cl,493.0
CCCCCCCCCN(N=Cc1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1)c1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1,ClC(Cl)Cl,508.0
CCCCCCCCCN(N=Cc1ccc(N(c2ccccc2)c2ccc(C=NN(CCCCCCCCC)c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)cc2)cc1)c1ccccc1,ClC(Cl)Cl,496.0
CCCCCCCCCOC1Cc2cc(/C=N/N(c3ccccc3)c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)ccc2N(c2ccccc2)C1,C1CCOC1,473.0
CCCCCCCCC[C@@]1(CCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)[C@H]4CCC[C@H]4N5c4ccc5c(c4)c4ccccc4n5CCCCCC)c4nsnc34)cc21,ClCCl,574.0
CCCCCCCCCc1c2ccccc2cc2c1oc1c3c(c4ccccc4c12)-c1c(c2oc4cc5ccccc5cc4c2c2ccccc12)OCO3,C1CCOC1,397.0
CCCCCCCCCc1c2ccccc2cc2c1oc1c3oc4c5oc6cc7ccccc7cc6c5c5ccccc5c4c3c3ccccc3c21,C1CCOC1,420.0
CCCCCCCCCc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,428.0
CCCCCCCCCc1nc(-c2nc(CCCCCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,432.0
CCCCCCCCCn1c(-c2cc(-c3nc4ccc(C)cc4n3CCCCCCCCC)cc(-c3nc4ccc(C)cc4n3CCCCCCCCC)c2)nc2ccc(C)cc21,ClCCl,307.5
CCCCCCCCCn1c(-c2cc(-c3nc4ccccc4n3CCCCCCCCC)cc(-c3nc4ccccc4n3CCCCCCCCC)c2)nc2ccccc21,ClCCl,300.0
CCCCCCCCN(CCCCCCCC)c1ccc(/C=C/c2ccc(C#Cc3ccc(-c4ccc(C#Cc5ccc(/C=C/c6ccc(N(CCCCCCCC)CCCCCCCC)cc6)cc5)cc4)cc3)cc2)cc1,Cc1ccccc1,406.0
CCCCCCCCN(CCCCCCCC)c1ccc(C#C/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4C#Cc2ccc(C(=O)O)cc2)cc1,C1CCOC1,677.0
CCCCCCCCN(CCCCCCCC)c1ccc(C#C/C2=c3\cc/c([nH]3)=C(\c3ccccc3)C3=N/C(=C(/C#Cc4ccc(C(=O)O)cc4)c4ccc([nH]4)/C(c4ccccc4)=C4\NC2CC4(C)C)CC3(C)C)cc1,C1CCOC1,769.0
CCCCCCCCN(CCCCCCCC)c1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(/C=C(/C#N)C(=O)O)cc3)c3ccccc23)cc1,C1CCOC1,509.0
CCCCCCCCN(CCCCCCCC)c1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccccc23)cc1,C1CCOC1,509.0
CCCCCCCCN(CCCCCCCC)c1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(C(=O)O)c([N+](=O)[O-])c3)c3ccccc23)cc1,C1CCOC1,503.0
CCCCCCCCN(CCCCCCCC)c1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(C(=O)O)cc3)c3ccccc23)cc1,C1CCOC1,499.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C(O)/C(=C/c3sc4ccccc4[n+]3CC(=O)O)C2=O)cc1,C1CCOC1,623.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C(O)/C(=C/c3sc4ccccc4[n+]3CC(=O)O)C2=O)cc1,CN(C)C=O,600.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C(O)/C(=C/c3sc4ccccc4[n+]3CC(=O)O)C2=O)cc1,CO,600.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C(O)/C(=C/c3sc4ccccc4[n+]3CC(=O)O)C2=O)cc1,CS(C)=O,605.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C(O)/C(=C/c3sc4ccccc4[n+]3CC(=O)O)C2=O)cc1,Cc1ccccc1,619.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C(O)/C(=C/c3sc4ccccc4[n+]3CC(=O)O)C2=O)cc1,c1ccccc1,624.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/C3=[N+](CC(=O)O)c4ccccc4C3(C)C)C2=O)cc1,C1CCOC1,630.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/C3=[N+](CC(=O)O)c4ccccc4C3(C)C)C2=O)cc1,CN(C)C=O,620.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/C3=[N+](CC(=O)O)c4ccccc4C3(C)C)C2=O)cc1,CO,620.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/C3=[N+](CC(=O)O)c4ccccc4C3(C)C)C2=O)cc1,CS(C)=O,624.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/C3=[N+](CC(=O)O)c4ccccc4C3(C)C)C2=O)cc1,Cc1ccccc1,633.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/C3=[N+](CC(=O)O)c4ccccc4C3(C)C)C2=O)cc1,c1ccccc1,634.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/c3[se]c4ccccc4[n+]3CC(=O)O)C2=O)cc1,C1CCOC1,631.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/c3[se]c4ccccc4[n+]3CC(=O)O)C2=O)cc1,CN(C)C=O,611.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/c3[se]c4ccccc4[n+]3CC(=O)O)C2=O)cc1,CO,610.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/c3[se]c4ccccc4[n+]3CC(=O)O)C2=O)cc1,CS(C)=O,619.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/c3[se]c4ccccc4[n+]3CC(=O)O)C2=O)cc1,Cc1ccccc1,624.0
CCCCCCCCN(CCCCCCCC)c1ccc(C2=C([O-])/C(=C/c3[se]c4ccccc4[n+]3CC(=O)O)C2=O)cc1,c1ccccc1,624.0
CCCCCCCCN(CCCCCCCC)c1ccc2c3c1cccc3/c(=C/C1=C([O-])/C(=C/C3=[N+](CCCCCCCC)c4ccc5cc(C(=O)O)ccc5c4C3(C)C)C1=O)n2CCCCCC,CCO,820.0
CCCCCCCCN(CCCCCCCC)c1ccc2c3ccc4c5c(ccc(c6cccc1c62)c53)C(=O)N(CC(=O)O)C4=O,CC#N,500.0
CCCCCCCCN(CCCCCCCC)c1ccc2c3ccc4c5c(ccc(c6cccc1c62)c53)C(=O)OC4=O,CC#N,560.0
CCCCCCCCN(CCCCCCCC)c1ccc2c3ccc4c5c(ccc(c6cccc1c62)c53)C(=O)OC4=O,CS(C)=O,564.0
CCCCCCCCN(c1ccc(C=C2C(=O)NC(=S)NC2=O)cc1)c1ccc(C=C2C(=O)NC(=S)NC2=O)cc1,C1CCOC1,506.0
CCCCCCCCN(c1ccccc1)c1ccc(C=C2C(=O)NC(=O)NC2=O)cc1,C1CCOC1,451.0
CCCCCCCCN(c1ccccc1)c1ccc(C=C2C(=O)NC(=S)NC2=O)cc1,C1CCOC1,482.0
CCCCCCCCN1/C(=C/C2/C(=C(/C#N)C(=O)OCC)C(=CC3=[N+](CCCCCCCC)c4cccc(C(=O)O)c4C3(C)C)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,703.0
CCCCCCCCN1/C(=C/C2=C([O-])/C(=C/C3=[N+](CCCCCCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,CN(C)C=O,688.0
CCCCCCCCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CCCCCCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,CN(C)C=O,688.0
CCCCCCCCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CCCCCCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=O)C(C)(C)c2cc(C(=O)O)ccc21,CCO,646.0
CCCCCCCCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CCCCCCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=O)C(C)(C)c2cc(C(=O)O)ccc21,ClCCl,646.0
CCCCCCCCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CCCCCCCC)c4ccc(C(=O)O)cc4C3)C2=C(C#N)C(=O)OCC)C(C)(C)c2cc(C(=O)O)ccc21,CCO,703.0
CCCCCCCCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CCCCCCCC)c4ccc(C(=O)O)cc4C3)C2=C(C#N)C(=O)OCC)C(C)(C)c2ccccc21,CCO,695.0
CCCCCCCCN1C(=CC2=C([O-])/C(=C\C3c4cccc5cccc(c45)[NH+]3CCCCCC)C2=O)C(C)(C)c2ccc(C(=O)O)cc21,CCO,676.0
CCCCCCCCN1C(=CC2=C([O-])/C(=C\c3ccc4ccccc4[n+]3CC)C2=O)C(C)(C)c2ccc(C(=O)O)cc21,CCO,656.0
CCCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](C)c4c(ccc5c6c(ccc45)C(C)(C)C(C=C4C(=O)C(C=C5N(CC)c7ccc8ccccc8c7C5(C)C)=C4[O-])=[N+]6C)C3(C)C)C2=O)C(C)(C)c2cc(C(=O)O)ccc21,CN(C)C=O,730.0
CCCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](C)c4c(ccc5c6c(ccc45)C(C)(C)C(C=C4C(=O)C(C=C5N(CC)c7ccc8ccccc8c7C5(C)C)=C4[O-])=[N+]6C)C3(C)C)C2=O)C(C)(C)c2cc(C(=O)O)ccc21,CS(C)=O,740.0
CCCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=C(C#N)C(=O)OCC)C(C)(C)c2ccccc21,CN(C)C=O,695.0
CCCCCCCCN1C(=Cc2c(OCC)c(=O)c2=O)C(C)(C)c2cc(C(=O)O)ccc21,CCO,428.0
CCCCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCCCC)c3cc(-c4ccc(/C=C(/C#N)C(=O)O)o4)ccc32)c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc21,ClCCl,589.0
CCCCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCCCC)c3cc(-c4ccc(/C=C(/C#N)C(=O)O)o4)ccc32)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,571.0
CCCCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCCCC)c3cc(-c4ccc(/C=C(/C#N)C(=O)O)s4)ccc32)c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc21,ClCCl,584.0
CCCCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCCCC)c3cc(-c4ccc(/C=C(/C#N)C(=O)O)s4)ccc32)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,563.0
CCCCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc32)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,563.0
CCCCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCCCC)c3cc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4)ccc32)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc21,ClCCl,568.0
CCCCCCCCN1C(=O)/C(=c2\s/c(=C\c3ccc(N(c4ccccc4)c4ccc(/C=c5/s/c(=C6/SC(=S)N(CCCCCCCC)C6=O)n(CC(=O)O)c5=O)cc4)cc3)c(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,535.0
CCCCCCCCN1C(=O)/C(=c2\s/c(=C\c3ccc4c(c3)C3CCCC3N4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)c(=O)n2CC(=O)O)SC1=S,C1CCOC1,532.0
CCCCCCCCN1C(=O)/C(=c2\s/c(=C\c3ccc4c(c3)C3CCCC3N4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)c(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,554.0
CCCCCCCCN1C(=O)/C(=c2\s/c(=C\c3ccc4c(c3)C3CCCC3N4c3ccccc3OCCCC)c(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,545.0
CCCCCCCCN1C(=O)/C(=c2\s/c(=c3/c(=Cc4ccc5c(c4)C4CCCC4N5c4ccc(C=C(c5ccccc5)c5ccccc5)cc4)sc(=O)n3CC(=O)O)c(=O)n2-c2ccccc2)SC1=S,ClC(Cl)Cl,570.0
CCCCCCCCN1C(=O)/C(=c2\s/c(=c3/c(=Cc4ccc5c(c4)C4CCCC4N5c4ccc(C=C(c5ccccc5)c5ccccc5)cc4)sc(=O)n3CC(=O)O)c(=O)n2CCCCCCCC)SC1=S,ClC(Cl)Cl,574.0
CCCCCCCCN1C(=O)C2=C(c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cn3)N(CCCCCCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)cn1,C1CCOC1,588.0
CCCCCCCCN1C(=O)C2=C(c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cn3)N(CCCCCCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cn1,C1CCOC1,579.0
CCCCCCCCN1C(=O)C2=C(c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4)cc3)N(CC(=O)O)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)cc1,ClCCl,521.0
CCCCCCCCN1C(=O)C2=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)N(CC(=O)O)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,509.0
CCCCCCCCN1C(=O)C2=C(c3ccc(-c4sc(-c5ccc(N(c6ccc7c(c6)C(CCCCCC)(CCCCCC)c6ccccc6-7)c6ccc7c(c6)C(CCCCCC)(CCCCCC)c6ccccc6-7)cc5)c5c4OCCO5)s3)N(CCCCCCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)s1,ClCCl,727.0
CCCCCCCCN1C(=O)S/C(=c2/c(=Cc3ccc4c(c3)C3CCCC3N4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)sc(=O)n2CC(=O)O)C1=O,ClC(Cl)Cl,521.0
CCCCCCCCN1C(=O)c2c(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2C1=O,ClCCl,442.0
CCCCCCCCN1C(=O)c2c(-c3ccc4c(c3)[C@H]3CCC[C@H]3N4c3ccc(C)cc3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2C1=O,ClCCl,442.0
CCCCCCCCN1C(=O)c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3c4c(cc(-c5ccc(C=C(C#N)C(=O)O)s5)c(c24)C1=O)C(=O)N(CCCCCCCC)C3=O,ClC(Cl)Cl,533.0
CCCCCCCCN1C(=O)c2cc(N3CCCCC3)c3c4ccc5c6c(ccc(c7c(N8CCCCC8)cc(c2c37)C1=O)c64)C(=O)OC5=O,ClCCl,648.0
CCCCCCCCN1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc(C(=O)O)c5c(C(=O)O)cc(Oc6ccc(C(C)(C)C)cc6)c(c6c(Oc7ccc(C(C)(C)C)cc7)cc(c2c36)C1=O)c54,ClCCl,537.0
CCCCCCCCN1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c(=O)n6c7cc(C(=O)O)ccc7nc6c6cc(Oc7ccc(C(C)(C)C)cc7)c(c7c(Oc8ccc(C(C)(C)C)cc8)cc(c2c37)C1=O)c4c56,ClCCl,602.0
CCCCCCCCN1C(=O)c2ccc3c4c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc5c6c(cc(-c7ccc(-n8c9ccccc9c9ccccc98)cc7)c(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCCCCCC)C5=O,ClC(Cl)Cl,551.0
CCCCCCCCN1C(=O)c2ccc3c4c(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc5c6c(ccc(c7c(-c8ccc(-n9c%10ccccc%10c%10ccccc%109)cc8)cc(c2c37)C1=O)c64)C(=O)N(CCCCCCCC)C5=O,ClC(Cl)Cl,561.0
CCCCCCCCN1C(=O)c2ccc3c4c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc5c6c(cc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)c(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCCCCCC)C5=O,ClC(Cl)Cl,606.0
CCCCCCCCN1C(=O)c2ccc3c4c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc5c6c(ccc(c7c(-c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc(c2c37)C1=O)c64)C(=O)N(CCCCCCCC)C5=O,ClC(Cl)Cl,645.0
CCCCCCCCN1C(=O)c2ccc3c4c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc5c6c(cc(-c7ccc8c(c7)c7ccccc7n8-c7ccccc7)c(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCCCCCC)C5=O,ClC(Cl)Cl,563.0
CCCCCCCCN1C(=O)c2ccc3c4c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc5c6c(ccc(c7c(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)cc(c2c37)C1=O)c64)C(=O)N(CCCCCCCC)C5=O,ClC(Cl)Cl,609.0
CCCCCCCCN1C(=O)c2ccc3c4c(N5CCCCC5)cc5c6c(ccc(c7c(N8CCCCC8)cc(c2c37)C1=O)c64)C(=O)OC5=O,ClCCl,692.0
CCCCCCCCN1c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)s4)s3)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,455.0
CCCCCCCCN1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)s3)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,432.0
CCCCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,426.0
CCCCCCCCN1c2ccc(-c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,449.0
CCCCCCCCN1c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc2Sc2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc21,ClCCl,460.0
CCCCCCCCN1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,450.0
CCCCCCCCN1c2ccc(-c3ccc(OC)cc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,439.0
CCCCCCCCN1c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc2Sc2cc(-c3ccc(-c4ccc(C(=O)O)cc4)c4nsnc34)ccc21,C1CCOC1,452.0
CCCCCCCCN1c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc2Sc2cc(-c3ccc(-c4ccc(C(=O)O)cc4)c4nsnc34)ccc21,ClCCl,452.0
CCCCCCCCN1c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc2Sc2cc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)c4nsnc34)ccc21,ClCCl,410.0
CCCCCCCCN1c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc2Sc2cc(-c3ccc(-c4ccncc4)c4nsnc34)ccc21,ClCCl,454.0
CCCCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Oc2cc(-c3ccc(OCCCC)cc3OCCCC)ccc21,CCO,480.0
CCCCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Oc2cc(-c3ccc(OCCCC)cc3OCCCC)ccc21,ClCCl,506.0
CCCCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6ccc(-c7ccc(N(c8ccc(-c9ccc(CCCC)cc9)cc8)c8ccc(-c9ccc(CCCC)cc9)cc8)cc7)s6)=C5C(=O)N4CC(CC)CCCC)s3)ccc21,ClCCl,608.0
CCCCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6ccc(-c7ccc8c(c7)Sc7ccccc7N8CCCCCC)s6)=C5C(=O)N4CC(CC)CCCC)s3)ccc21,ClCCl,604.0
CCCCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6cccs6)=C5C(=O)N4CC(CC)CCCC)s3)ccc21,ClCCl,576.0
CCCCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(OCCCCCC)cc3)ccc21,ClCCl,449.0
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=C(C#N)C(=O)O)ccc21,ClC(Cl)Cl,439.0
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=O)ccc21,C1CCOC1,384.0061441
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=O)ccc21,CC#N,380.002855
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=O)ccc21,CCCCCC,376.00822
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=O)ccc21,CO,362.0040544
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=O)ccc21,CS(C)=O,389.9870711
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=O)ccc21,Cc1ccccc1,381.9948205
CCCCCCCCN1c2ccc(C#Cc3ccc(C(F)(F)F)cc3)cc2Sc2cc(C=O)ccc21,ClC(Cl)Cl,389.9914348
CCCCCCCCN1c2ccc(C#Cc3ccc(F)cc3)cc2Sc2cc(C=O)ccc21,C1CCOC1,377.9978434
CCCCCCCCN1c2ccc(C#Cc3ccc(F)cc3)cc2Sc2cc(C=O)ccc21,CC#N,380.0061931
CCCCCCCCN1c2ccc(C#Cc3ccc(F)cc3)cc2Sc2cc(C=O)ccc21,CCCCCC,375.9991716
CCCCCCCCN1c2ccc(C#Cc3ccc(F)cc3)cc2Sc2cc(C=O)ccc21,CO,350.0024635
CCCCCCCCN1c2ccc(C#Cc3ccc(F)cc3)cc2Sc2cc(C=O)ccc21,CS(C)=O,388.0001712
CCCCCCCCN1c2ccc(C#Cc3ccc(F)cc3)cc2Sc2cc(C=O)ccc21,Cc1ccccc1,381.987518
CCCCCCCCN1c2ccc(C#Cc3ccc(F)cc3)cc2Sc2cc(C=O)ccc21,ClC(Cl)Cl,391.98968
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=C(C#N)C(=O)O)ccc21,ClC(Cl)Cl,444.0
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=O)ccc21,C1CCOC1,377.9968059
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=O)ccc21,CC#N,380.0061931
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=O)ccc21,CCCCCC,374.0007404
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=O)ccc21,CO,351.114668
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=O)ccc21,CS(C)=O,383.4507346
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=O)ccc21,Cc1ccccc1,382.997322
CCCCCCCCN1c2ccc(C#Cc3ccc(OC)cc3)cc2Sc2cc(C=O)ccc21,ClC(Cl)Cl,382.4973868
CCCCCCCCN1c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2Sc2cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)ccc21,CC#N,476.0
CCCCCCCCN1c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2Sc2cc(C=C(C#N)C#N)ccc21,CC#N,471.0
CCCCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccc(-c5ccc6c(c5)Sc5cc(C=C(C#N)C(=O)O)ccc5N6CCCCCCCC)cc4)c4ccc(C)cc4C)cc3)ccc21,ClC(Cl)Cl,475.0
CCCCCCCCN1c2ccccc2Oc2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,CCO,510.0
CCCCCCCCN1c2ccccc2Oc2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,ClCCl,518.0
CCCCCCCCN1c2ccccc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21,CCO,480.0
CCCCCCCCN1c2ccccc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,491.0
CCCCCCCCN1c2ccccc2Sc2cc(-c3cc4nc5c6cccnc6c6ncccc6c5nc4cc3-c3ccc4c(c3)Sc3ccccc3N4CCCCCCCC)ccc21,ClCCl,456.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc21,ClCCl,496.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)ccc21,C1CCOC1,409.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,C1CCOC1,534.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,CCOC(C)=O,524.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,CN(C)C=O,528.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,Cc1ccccc1,533.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,ClC(Cl)Cl,534.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)c7ccc(/C=C/c8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,ClCCl,533.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,C1CCOC1,530.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,CCOC(C)=O,519.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,CN(C)C=O,530.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,Cc1ccccc1,530.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,ClC(Cl)Cl,530.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)Sc5ccccc5N6CCCCCCCC)cc4)c4ccc(/C=C/c5ccc(/C=C/c6ccc(N(c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)c7ccc(/C=C/c8ccc9c(c8)Sc8ccccc8N9CCCCCCCC)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,ClCCl,533.0
CCCCCCCCN1c2ccccc2Sc2cc(/C=C\c3sc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3/C=C/c3ccc4c(c3)Sc3ccccc3N4CCCCCCCC)ccc21,ClCCl,508.0
CCCCCCCCOC(=O)c1cc2ccc3ccccc3c2c(C#N)c1N,Cc1ccccc1,435.0
CCCCCCCCOC(=O)c1ccc(-c2cc3ccc4cc(-c5ccc(C(=O)OCCCCCCCC)cc5)cc5ccc(c2)c3c45)cc1,Cc1ccccc1,404.0
CCCCCCCCOCc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(CCc2c(OCCCC)cc(C(=O)O)cc2OCCCC)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(C)cc1)c1ccc(C)cc1)=C1/C=CC(=N1)/C=3N(c1ccc(C)cc1)c1ccc(C)cc1,CCO,662.0
CCCCCCCCOCc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(CCc2c(OCCCCCCCC)cc(C(=O)O)cc2OCCCCCCCC)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(C)cc1)c1ccc(C)cc1)=C1/C=CC(=N1)/C=3N(c1ccc(C)cc1)c1ccc(C)cc1,CCO,663.0
CCCCCCCCOCc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(CCc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(C)cc1)c1ccc(C)cc1)=C1/C=CC(=N1)/C=3N(c1ccc(C)cc1)c1ccc(C)cc1,CCO,657.0
CCCCCCCCOc1c(/C=C(/C#N)C(=O)O)sc(/C=N/N(c2ccccc2)c2ccccc2)c1OCCCCCCCC,C1CCOC1,483.0
CCCCCCCCOc1c(/C=C/C=C/c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)cc(-c2cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s2)cc1/C=C/C=C/c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,410.0
CCCCCCCCOc1c(/C=C/c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)cc(-c2cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s2)cc1/C=C/c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,401.0
CCCCCCCCOc1c(/C=C/c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)cc(-c2ccc(-c3c(F)c(F)c(-c4ccc(C(=O)O)cc4)c4nsnc34)s2)cc1/C=C/c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,399.0
CCCCCCCCOc1c(/C=C/c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1/C=C/c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,400.0
CCCCCCCCOc1c(/C=C/c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)cc(-c2ccc(C3=C4C(=O)N(CC(CC)CCCC)C(c5ccc(-c6ccc(C(=O)O)cc6)s5)=C4C(=O)N3CC(CC)CCCC)s2)cc1/C=C/c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,610.0
CCCCCCCCOc1c(/C=N/N(c2ccccc2)c2ccccc2)sc(/C=C(\C#N)C(=O)O)c1OCCCCCCCC,C1CCOC1,483.0
CCCCCCCCOc1c(C)cc(-c2cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s2)cc1C,ClC(Cl)Cl,413.0
CCCCCCCCOc1c(OCCCCCCCC)c(-c2ccc(/C=C(/C#N)C(=O)O)o2)c2nsnc2c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,463.0
CCCCCCCCOc1c(OCCCCCCCC)c(-c2ccc(/C=C(/C#N)C(=O)O)s2)c2nsnc2c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,468.0
CCCCCCCCOc1c(OCCCCCCCC)c(-c2ccc(/C=C(\C#N)C(=O)O)s2)c2nc3c4ccccc4c4ccccc4c3nc2c1-c1ccc2c(c1)[C@H]1CCC[C@H]1N2c1ccc(C)cc1,ClCCl,524.0
CCCCCCCCOc1c(OCCCCCCCC)c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2nsnc2c1-c1ccc(/C=C(/C#N)C(=O)O)cc1,ClCCl,423.0
CCCCCCCCOc1c(OCCCCCCCC)c(-c2ccc(N(c3ccccc3)c3ccccc3)s2)c2nsnc2c1-c1ccc(/C=C(/C#N)C(=O)O)o1,ClCCl,525.0
CCCCCCCCOc1c(OCCCCCCCC)c(-c2ccc(N(c3ccccc3)c3ccccc3)s2)c2nsnc2c1-c1ccc(/C=C(/C#N)C(=O)O)s1,ClCCl,531.0
CCCCCCCCOc1c(OCCCCCCCC)c(-c2ccc(N(c3ccccc3)c3ccccc3)s2)c2nsnc2c1-c1ccc(/C=C(\C#N)C(=O)O)cc1,ClCCl,483.0
CCCCCCCCOc1c2cccc3c(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc4c(OCCCCCCCC)c5cccc6c(-c7ccc(/C=C(\C#N)C(=O)O)s7)cc1c(c65)c4c32,C1CCOC1,464.0
CCCCCCCCOc1c2cccc3c(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc4c(OCCCCCCCC)c5cccc6c(-c7ccc(N(c8ccc(C)cc8)c8ccc(C)cc8)cc7)cc1c(c65)c4c32,C1CCOC1,461.0
CCCCCCCCOc1cc(/C=C/C2=[N+]3C(=C4c5ccc(/C=C/c6cc(OCCCCCCCC)c(C=O)cc6OCCCCCCCC)n5[B-](F)(F)[n+]5c4n(c4ccccc45)[B-]3(F)F)C=C2)c(OCCCCCCCC)cc1C=O,ClCCl,783.0
CCCCCCCCOc1cc(/C=C/c2cc(OCCCCCCCC)c(/C=C/c3cc(OCCCCCCCC)c(/C=C/c4cc[n+](Cc5ccc(C)cc5)cc4)cc3OCCCCCCCC)cc2OCCCCCCCC)c(OCCCCCCCC)cc1/C=C/c1cc[n+](Cc2ccc(C)cc2)cc1,ClCCl,535.0
CCCCCCCCOc1cc(/C=C/c2cc(OCCCCCCCC)c(/C=C/c3cc(OCCCCCCCC)c(/C=C/c4ccncc4)cc3OCCCCCCCC)cc2OCCCCCCCC)c(OCCCCCCCC)cc1/C=C/c1ccncc1,ClCCl,452.0
CCCCCCCCOc1cc(/C=C/c2cc[n+](Cc3ccc(C)cc3)cc2)c(OCCCCCCCC)cc1/C=C/c1cc[n+](Cc2ccc(C)cc2)cc1,ClCCl,490.0
CCCCCCCCOc1cc(/C=C/c2ccncc2)c(OCCCCCCCC)cc1/C=C/c1ccncc1,ClCCl,398.0
CCCCCCCCOc1cc(C)cc(OCCCCCCCC)c1-n1c2cc(-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)c3cccc4c5cccc6c(-c7cc8c(s7)-c7sc(C=C(C#N)C(=O)O)cc7C8(CCCCCC)CCCCCC)cc1c(c65)c2c34,ClC(Cl)Cl,550.0
CCCCCCCCOc1cc(C)cc(OCCCCCCCC)c1-n1c2cc(-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)c3cccc4c5cccc6c(-c7ccc(-c8cc9c(s8)-c8sc(C=C(C#N)C(=O)O)cc8C9(CCCCCC)CCCCCC)c8nsnc78)cc1c(c65)c2c34,ClC(Cl)Cl,502.0
CCCCCCCCOc1cc(C)cc(OCCCCCCCC)c1-n1c2cc(C#Cc3ccc(C(=O)O)cc3)c3cccc4c5cccc6c(C#Cc7ccc(N(c8ccc(OCCCCCC)cc8)c8ccc(OCCCCCC)cc8)cc7)cc1c(c65)c2c34,ClCCl,501.0
CCCCCCCCOc1cc(C)cc(OCCCCCCCC)c1-n1c2cc(C#Cc3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)c3cccc4c5cccc6c(C#Cc7ccc(-c8ccc(C(=O)O)cc8)c8nsnc78)cc1c(c65)c2c34,ClCCl,532.0
CCCCCCCCOc1cc(C)cc(OCCCCCCCC)c1-n1c2cc(C=C(C#N)C(=O)O)c3cccc4c5cccc6c(-c7ccc(N(c8ccc(OCCCCCC)cc8)c8ccc(OCCCCCC)cc8)cc7)cc1c(c65)c2c34,ClC(Cl)Cl,531.0
CCCCCCCCOc1cc(OCCCCCCCC)cc(/C2=C3\C=CC(=N3)/C(N(c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3ccccc3-4)c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3ccccc3-4)=c3/cc/c4n3[Zn]n3c(ccc32)/C(C#Cc2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2cc(OCCCCCCCC)cc(OCCCCCCCC)c2)c1,CC#N,443.0
CCCCCCCCOc1cc2c(cc1OCCCCCCCC)c1cc(-c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4)c4nsnc34)sc1c1sc(CC(CN)C(O)O)cc21,C1CCOC1,526.0
CCCCCCCCOc1cc2c(cc1OCCCCCCCC)c1cc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)sc1c1sc(C=C(C#N)C(=O)O)cc21,C1CCOC1,471.0
CCCCCCCCOc1cc2c(cc1OCCCCCCCC)c1cc(-c3sc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4)c4c3OCCO4)sc1c1sc(C=C(C#N)C(=O)O)cc21,C1CCOC1,495.0
CCCCCCCCOc1ccc(-c2c(-c3c(-c4ccc(OCCCCCCCC)cc4)n(CCCCCCCC)c4cc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)ccc34)c3cc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)ccc3n2CCCCCCCC)cc1,C1CCOC1,484.0
CCCCCCCCOc1ccc(-c2c(-c3c(-c4ccc(OCCCCCCCC)cc4)n(CCCCCCCC)c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)o5)cc34)c3cc(-c4ccc(/C=C(/C#N)C(=O)O)o4)ccc3n2CCCCCCCC)cc1,C1CCOC1,468.0
CCCCCCCCOc1ccc(-c2c(-c3c(-c4ccc(OCCCCCCCC)cc4)n(CCCCCCCC)c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)cc34)c3cc(-c4ccc(/C=C(/C#N)C(=O)O)s4)ccc3n2CCCCCCCC)cc1,C1CCOC1,459.0
CCCCCCCCOc1ccc(-c2c3c4cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc4n(CCCCCCCC)c3c(-c3ccc(OCCCCCCCC)cc3)c3c4ccccc4n(CCCCCCCC)c23)cc1,ClCCl,485.0
CCCCCCCCOc1ccc(-c2c3c4n(c(-c5ccc(OCCCCCCCC)cc5)c3c3n2[B-](F)(F)[n+]2c(ccc5ccccc52)N=3)[B-](F)(F)[n+]2c(ccc3ccccc32)N=4)cc1,ClC(Cl)Cl,671.0
CCCCCCCCOc1ccc(-c2c3c4n(c(-c5ccc(OCCCCCCCC)cc5)c3c3n2[B-](F)(F)[n+]2c(sc5ccccc52)N=3)[B-](F)(F)[n+]2c(sc3ccccc32)N=4)cc1,ClC(Cl)Cl,655.0
CCCCCCCCOc1ccc(-c2c3c4n(c(-c5ccc(OCCCCCCCC)cc5)c3c3n2[B-](F)(F)[n+]2ccccc2N=3)[B-](F)(F)[n+]2ccccc2N=4)cc1,ClC(Cl)Cl,638.0
CCCCCCCCOc1ccc(-c2c3c4n(c(-c5ccc(OCCCCCCCC)cc5)c3c3n2[B-](c2ccccc2)(c2ccccc2)[n+]2c(ccc5cc(C(C)(C)C)ccc52)C=3C#N)[B-](c2ccccc2)(c2ccccc2)[n+]2c(ccc3cc(C(C)(C)C)ccc32)C=4C#N)cc1,ClC(Cl)Cl,819.0
CCCCCCCCOc1ccc(-c2ccc(C(=Cc3ccc(N4c5ccc(-c6ncc(-c7ccc(/C=C(\C#N)C(=O)O)s7)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(OCCCCCCCC)c1,ClCCl,557.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(-c6ccc(CCCCCC)cc6)c6sc(-c7ccc(-c8ccc(C(=O)O)cc8)c8nsnc78)cc6c(-c6ccc(CCCCCC)cc6)c5s4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(OCCCCCCCC)c1,ClCCl,487.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4cc6c(cc4C5(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)-c4sc(-c5c(F)c(F)c(-c7ccc(C(=O)O)cc7)c7nsnc57)cc4C6(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(OCCCCCCCC)c1,Cc1ccccc1,503.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4cc6c(cc4C5(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)-c4sc(-c5ccc(-c7ccc(C(=O)O)cc7)c7nonc57)cc4C6(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(COCCCCCCC)c1,Cc1ccccc1,536.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4cc6c(cc4C5(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)-c4sc(-c5ccc(-c7ccc(C(=O)O)cc7)c7nonc57)cc4C6(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(OCCCCCCCC)c1,Cc1ccccc1,536.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4cc6c(cc4C5(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)-c4sc(-c5ccc(-c7ccc(C(=O)O)cc7)c7nsnc57)cc4C6(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(COCCCCCCC)c1,Cc1ccccc1,519.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4cc6c(cc4C5(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)-c4sc(-c5ccc(-c7ccc(C(=O)O)cc7)c7nsnc57)cc4C6(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(OCCCCCCCC)c1,Cc1ccccc1,519.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4cc6c(cc4C5(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)-c4sc(-c5ccc(-c7ccc(C(=O)O)cc7)cc5)cc4C6(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(OCCCCCCCC)c1,Cc1ccccc1,441.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6ccc(C(=O)O)cc6)c6nsnc56)s4)cc3)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)cc2)c(OCCCCCCCC)c1,ClCCl,491.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCCCC)cc4)cc3)c3ccc(-c4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)cc3)cc2)cc1,C1CCOC1,456.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCCCC)cc4)cc3)c3ccc(-c4ccc(C#Cc5cc6c(OCCCCCCCC)c7sc(-c8ccc(C(=O)O)cc8)cc7c(OCCCCCCCC)c6s5)c5nsnc45)cc3)cc2)cc1,C1CCOC1,491.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCCCC)cc4)cc3)c3ccc(-c4ccc(C#Cc5cc6c(OCCCCCCCC)c7sc(-c8ccc(C(=O)O)s8)cc7c(OCCCCCCCC)c6s5)c5nsnc45)cc3)cc2)cc1,C1CCOC1,491.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3)c3ccc(-c4ncc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)cc3)cc2)c(OCCCCCCCC)c1,ClCCl,541.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5c(F)c(F)c(-c6ccc(C=C(C#N)C(=O)O)s6)c6nsnc56)sc3-4)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3-c3ccc(OCCCCCCCC)cc3OCCCCCCCC)cc2)c(OCCCCCCCC)c1,ClCCl,611.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6cc7c(s6)-c6sc(/C=C(\C#N)C(=O)O)cc6C7(CC(CC)CCCC)CC(CC)CCCC)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)sc3-4)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3-c3ccc(OCCCCCCCC)cc3OCCCCCCCC)cc2)c(OCCCCCCCC)c1,ClCCl,600.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)c6nsnc56)sc3-4)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3-c3ccc(OCCCCCCCC)cc3OCCCCCCCC)cc2)c(OCCCCCCCC)c1,ClCCl,616.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5cnc(-c6cc7c(s6)-c6sc(/C=C(\C#N)C(=O)O)cc6C7(CC(CC)CCCC)CC(CC)CCCC)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)sc3-4)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3-c3ccc(OCCCCCCCC)cc3OCCCCCCCC)cc2)c(OCCCCCCCC)c1,ClCCl,612.0
CCCCCCCCOc1ccc(-c2ccc(N(c3ccc4c(c3)C(C)(C)c3cc(-c5ncc(-c6ccc(C=C(C#N)C(=O)O)s6)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)sc3-4)c3ccc(-c4ccc(OCCCCCCCC)cc4OCCCCCCCC)cc3-c3ccc(OCCCCCCCC)cc3OCCCCCCCC)cc2)c(OCCCCCCCC)c1,ClCCl,628.0
CCCCCCCCOc1ccc(-c2ccc3c(c2)C(C)(C)c2cc(-c4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)cc4c5cc(-c6ccc(OCCCCCCCC)cc6)ccc5n-3c24)cc1,ClC(Cl)Cl,447.0
CCCCCCCCOc1ccc(-c2ccc3c(c2)C(C)(C)c2cc(-c4ccc(OCCCCCCCC)cc4)cc4c5cc(-c6ccc(-c7ccc(C(=O)O)cc7)c7nsnc67)ccc5n-3c24)cc1,ClC(Cl)Cl,449.0
CCCCCCCCOc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OCCCCCCCC)cc4)cc4c2n3-c2ccc(-c3ccc(-c5ccc(C(=O)O)cc5)c5nsnc35)cc2C4(C)C)cc1,ClC(Cl)Cl,449.0
CCCCCCCCOc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OCCCCCCCC)cc4)ccc2n3-c2ccc(-c3ccc(-c4ccc(C(=O)O)cc4)c4nsnc34)cc2)cc1,ClC(Cl)Cl,408.0
CCCCCCCCOc1ccc(-c2nc3c(-c4ccc(N(c5ccc(C(C)(C)C)cc5)c5ccc(C(C)(C)C)cc5)cc4)c4nc(-c5ccc(OCCCCCCCC)cc5)c(-c5ccc(OCCCCCCCC)cc5)nc4c(-c4ccc(/C=C(\C#N)C(=O)O)s4)c3nc2-c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,638.0
CCCCCCCCOc1ccc(-c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c3nc2-c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,470.0
CCCCCCCCOc1ccc(-c2nc3c(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)ccc(-c4cc5c6nc(CCCCCCCC)c(CCCCCCCC)nc6c6cc(-c7ccc(/C=C(\C#N)C(=O)O)s7)sc6c5s4)c3nc2-c2ccc(OCCCCCCCC)cc2)cc1,C1CCOC1,498.0
CCCCCCCCOc1ccc(-c2nc3c(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c3nc2-c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,523.0
CCCCCCCCOc1ccc(-c2nc3c(C4=CC=C(/C=C(/C#N)C(=O)O)C4)cnc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)c3nc2-c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,563.0
CCCCCCCCOc1ccc(-n2c(-c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)cc3c2cc(-c2ccc(-c4ccc(C=Cc5ccc(-c6ccc(C=C(C#N)C(=O)O)cc6)c6cscc56)s4)cc2)n3-c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,506.0
CCCCCCCCOc1ccc(/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccccc2)=C2/C=CC(=N2)/C=4C=CC(=O)O)cc1,CCO,430.0
CCCCCCCCOc1ccc(/C=N/c2ccc3[nH]c(OCCCCCC)nc3c2)c(O)c1,ClC(Cl)Cl,359.0
CCCCCCCCOc1ccc(C#Cc2c3cc4ccccc4cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc4ccccc4cc23)cc1,ClCCl,656.0
CCCCCCCCOc1ccc(C#Cc2c3cc4ccccc4cc3c(C#Cc3ccc(F)cc3)c3cc4ccccc4cc23)cc1,ClCCl,664.0
CCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCC)c(OCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCC,C1CCOC1,461.0
CCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCC)c(OCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCC,Cc1ccccc1,461.0
CCCCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCCCC)c(OCCCCCCCC)c3)c3nc4c5ccccc5c5ccccc5c4nc23)cc1OCCCCCCCC,ClCCl,461.0
CCCCCCCCOc1ccc(C#Cc2ccc3c(c2)c2ccccc2n3CCCCCCCC)c(OCCCCCCCC)c1,ClCCl,319.0
CCCCCCCCOc1ccc(C#Cc2ccc3oc4ccccc4c3c2)c(OCCCCCCCC)c1,ClCCl,314.0
CCCCCCCCOc1ccc(C2(c3ccc(OCCCCCCCC)cc3)c3cc4c5cc6c(cc5n(CCCCCCCC)c4cc3-c3sccc32)-c2sc(-c3c(F)c(F)c(-c4ccc(C(=O)O)cc4)c4nsnc34)cc2C6(c2ccc(OCCCCCCCC)cc2)c2ccc(OCCCCCCCC)cc2)cc1,ClC(Cl)Cl,509.0
CCCCCCCCOc1ccc(C2(c3ccc(OCCCCCCCC)cc3)c3cc4c5cc6c(cc5n(CCCCCCCC)c4cc3-c3sccc32)-c2sc(-c3cnc(-c4ccc(C(=O)O)cc4)c4nsnc34)cc2C6(c2ccc(OCCCCCCCC)cc2)c2ccc(OCCCCCCCC)cc2)cc1,ClC(Cl)Cl,568.0
CCCCCCCCOc1ccc(C2=C(c3ccc(OCCCCCCCC)cc3)C(C)(C)c3ccccc32)cc1,C1CCCCC1,281.0
CCCCCCCCOc1ccc(C2=C3C(C)=C(C#Cc4ccc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc4)C(C)=[N+]3[B-](F)(F)n3c(C)c(C#Cc4ccc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc4)c(C)c32)cc1,CC#N,568.5099846
CCCCCCCCOc1ccc(C2=C3C(C)=C(C#Cc4ccc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc4)C(C)=[N+]3[B-](F)(F)n3c(C)c(C#Cc4ccc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc4)c(C)c32)cc1,CCCCCC,580.1843318
CCCCCCCCOc1ccc(C2=C3C(C)=C(C#Cc4ccc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc4)C(C)=[N+]3[B-](F)(F)n3c(C)c(C#Cc4ccc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc4)c(C)c32)cc1,ClCCl,576.0
CCCCCCCCOc1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,ClCCl,500.0
CCCCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)-c3cc5c(cc3C4(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)-c3sc(-c4c(F)c(F)c(-c6ccc(C(=O)O)cc6)c6nsnc46)cc3C5(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)cc2)c2ccc(OCCCCCCCC)cc2OCCCCCCCC)c(OCCCCCCCC)c1,Cc1ccccc1,503.0
CCCCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)-c3cc5c(cc3C4(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)-c3sc(-c4ccc(-c6ccc(C(=O)O)cc6)c6nonc46)cc3C5(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)cc2)c2ccc(OCCCCCCCC)cc2OCCCCCCCC)c(OCCCCCCCC)c1,Cc1ccccc1,536.0
CCCCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)-c3cc5c(cc3C4(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)-c3sc(-c4ccc(-c6ccc(C(=O)O)cc6)c6nsnc46)cc3C5(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)cc2)c2ccc(OCCCCCCCC)cc2OCCCCCCCC)c(OCCCCCCCC)c1,Cc1ccccc1,519.0
CCCCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)-c3cc5c(cc3C4(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)-c3sc(-c4ccc(-c6ccc(C(=O)O)cc6)cc4)cc3C5(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)cc2)c2ccc(OCCCCCCCC)cc2OCCCCCCCC)c(OCCCCCCCC)c1,Cc1ccccc1,441.0
CCCCCCCCOc1ccc(N(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(N(c3ccccc3)c3ccc4c(c3)Sc3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3N4CCCCCCCC)cc2)cc1,C1CCOC1,478.0
CCCCCCCCOc1ccc(N(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc3c(c2)Sc2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2N3CCCCCCCC)cc1,C1CCOC1,481.0
CCCCCCCCOc1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc6c(c5)Sc5cc(-c7ccc(/C=C(\C#N)C(=O)O)s7)ccc5N6CCCCCCCC)cc4)cc3)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1,C1CCOC1,471.0
CCCCCCCCOc1ccc(N(c2ccc(-c3ccc4c(c3)Sc3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3N4CCCCCCCC)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1,C1CCOC1,475.0
CCCCCCCCOc1ccc(N(c2ccc(/C=C(\C#N)C(=O)O)cc2)c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,440.0
CCCCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(Nc4ncc(C=C(C#N)C(=O)O)cn4)cc3)cc2)c2ccc(OCCCCCCCC)cc2)cc1,Cc1ccccc1,388.0
CCCCCCCCOc1ccc(N(c2ccc(/C=c3\sc(=C(C#N)C#N)[nH]c3=O)cc2)c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,484.0
CCCCCCCCOc1ccc(N(c2ccc(C=C(C#N)C(=O)O)cc2)c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,440.0
CCCCCCCCOc1ccc(N(c2ccc(C=c3sc(=C(C#N)C#N)[nH]c3=O)cc2)c2ccc(OCCCCCCCC)cc2)cc1,ClCCl,484.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3c(OCCCCCCCC)c(OCCCCCCCC)c(-c4ccc(/C=c5/sc(=C(C#N)C#N)[nH]c5=O)s4)c4nsnc34)cc2)cc1,ClCCl,492.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3cc(CCCCCC)c(-c4sc(-c5sc(C=C(C#N)C(=O)O)cc5CCCCCC)c5nccnc45)s3)cc2)cc1,ClC(Cl)Cl,365.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3cc4sc5c6sc7cc(/C=C(/C#N)C(=O)O)sc7c6c(OCC(CC)CCCC)c(OCC(CC)CCCC)c5c4s3)cc2)cc1,C1CCOC1,478.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4c(F)c(F)c(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)s3)cc2)cc1,Cc1ccccc1,525.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4c(F)c(F)c(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nccnc45)s3)cc2)cc1,Cc1ccccc1,511.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4cc5sc6c7sc8cc(/C=C(\C#N)C(=O)O)sc8c7c7cc(OCC(CC)CCCC)c(OCC(CC)CCCC)cc7c6c5s4)c4nsnc34)cc2)cc1,C1CCOC1,531.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nccnc45)s3)cc2)cc1,Cc1ccccc1,504.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)cc4)c4n[se]nc34)cc2)cc1,C1CCOC1,522.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)c4n[se]nc34)cc2)cc1,C1CCOC1,503.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,ClCCl,509.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)c4n[se]nc34)cc2)cc1,C1CCOC1,488.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c4n[se]nc34)cc2)cc1,C1CCOC1,522.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c4nsnc34)cc2)cc1,ClCCl,526.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(C=c5sc(=C(C#N)C#N)[nH]c5=O)s4)c4nsnc34)cc2)cc1,ClCCl,539.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4nc5sc(-c6sc(C=C(C#N)C(=O)O)cc6CCCCCCCC)nc5s4)s3)cc2)cc1,C1CCOC1,489.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(C(=O)O)cc5)c5nccnc45)cc3)cc2)cc1,Cc1ccccc1,511.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(C=C(C#N)C(=O)O)cc5)c5nccnc45)cc3)cc2)cc1,Cc1ccccc1,525.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nccnc45)s3)cc2)cc1,Cc1ccccc1,520.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nccnc45)s3)cc2)cc1,ClC(Cl)Cl,525.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(/C=C(/C#N)C(=O)O)c5c4OCCO5)c4nccnc34)cc2)cc1,Cc1ccccc1,486.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1,ClCCl,477.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(/C=c4\sc(=C(C#N)C#N)[nH]c4=O)s3)cc2)cc1,ClCCl,519.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,ClCCl,477.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ccc(C=c4sc(=C(C#N)C#N)[nH]c4=O)s3)cc2)cc1,ClCCl,519.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ncc(-c4ccc(/C=C(/C#N)C(=O)O)s4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,ClCCl,533.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3ncc(-c4ccc(C=C(C#N)C(=O)O)s4)c4nc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)nc34)cc2)cc1,ClCCl,461.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(-c5sc(/C=C(/C#N)C(=O)O)c6c5OCCO6)c5nccnc45)c4c3OCCO4)cc2)cc1,Cc1ccccc1,548.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(-c5sc(/C=C6\SC(=S)N(C(=O)O)C6=O)c6c5OCCO6)c5nccnc45)c4c3OCCO4)cc2)cc1,Cc1ccccc1,584.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(/C=C(/C#N)C(=O)O)cc4)c4nccnc34)cc2)cc1,Cc1ccccc1,572.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(C(=O)O)cc4)c4nccnc34)cc2)cc1,Cc1ccccc1,549.0
CCCCCCCCOc1ccc(N(c2ccc(OCCCCCCCC)cc2)c2ccc3c(c2)-c2cc(N(c4ccc(OCCCCCCCC)cc4)c4ccc(OCCCCCCCC)cc4)ccc2C3=Cc2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)s2)cc1,ClCCl,516.0
CCCCCCCCOc1ccc(OCCCCCCCC)c(/C=C/C2=[N+]3C(=C4c5ccc(/C=C/c6cc(OCCCCCCCC)ccc6OCCCCCCCC)n5[B-](F)(F)[n+]5c4n(c4ccccc45)[B-]3(F)F)C=C2)c1,ClCCl,784.0
CCCCCCCCOc1ccc2c(c1)c(-c1ccc(/C=C(/C#N)C(=O)OCC)cc1)nn2-c1ccccc1,C1CCOC1,394.0
CCCCCCCCOc1ccc2c(c1)c(-c1ccc(C(=O)OC)cc1)nn2-c1ccccc1,C1CCOC1,347.0
CCCCCCCCOc1ccc2c(c1)c(-c1ccc(C=O)cc1)nn2-c1ccccc1,C1CCOC1,356.0
CCCCCCCCOc1ccc2c(c1)c(-c1ccccc1)nn2-c1ccccc1,C1CCOC1,337.0
CCCCCCCCOc1ccc2c3c(c4ccc(OCCCCCCCC)cc4c2c1)C(C)(C)c1ccccc1-3,C1CCCCC1,388.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2c3ccccc3c(/C=C(\C#N)C(=O)O)c3ccccc23)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(CCCCCC)cc1)c1ccc(CCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,660.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2c3ccccc3c(C(=O)O)c3ccccc23)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(CCCCCC)cc1)c1ccc(CCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,657.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(-c3ccc(C(=O)NN)cc3)c3nsnc23)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccc2c(c1)Sc1cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)ccc1N2CCCCCCCC)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,435.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(-c3ccc(C(=O)O)cc3)c3nsnc23)=c2/cc/c3n2[Zn]n2c1cc1c2/C(=C2/C=CC(=N2)/C=3c2c(OCCCCCCCC)cccc2OCCCCCCCC)c2sc(C#Cc3ccc(OCCCCCC)cc3)cc2C1(CCCC)CCCC,C1CCOC1,470.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(/C=C(\C#N)C(=O)O)c3ccccc23)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(CCCCCC)cc1)c1ccc(CCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,655.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)c3ccccc23)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(CCCCCC)cc1)c1ccc(CCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,648.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)c3nsnc23)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(CCCCCC)cc1)c1ccc(CCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,669.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#CC1=CC=C(n2c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc42)CC1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClC(Cl)Cl,620.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1c2ccccc2c(N(c2ccc(OC)cc2)c2ccc(OC)cc2)c2ccccc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClC(Cl)Cl,664.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(N(CCCC)c2ccc(CCCCCC)cc2)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,666.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,663.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccc(N(c2ccc(-c4cccs4)cc2)c2ccc(-c4cccs4)cc2)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClC(Cl)Cl,449.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClC(Cl)Cl,442.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(C)cc1)c1ccc(C)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,644.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc2ccccc2c1)c1ccc2ccccc2c1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,646.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccccc1)c1ccccc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,641.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)s2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccc(N(c2ccc(-c4cccs4)cc2)c2ccc(-c4cccs4)cc2)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClC(Cl)Cl,454.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)s2)=c2/cc/c3n2[Zn]n2c(ccc21)/C=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClC(Cl)Cl,449.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(CCCCCCCC)CCCCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1c(F)c(F)c(-c2ccc(C(=O)O)s2)c2nsnc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,698.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(CCCCCCCC)CCCCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1c(F)cc(-c2ccc(C(=O)O)s2)c2nsnc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,701.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(CCCCCCCC)CCCCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(-c2ccc(C(=O)O)s2)c2nsnc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,699.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(/C=C(\C#N)C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,677.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,667.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClC(Cl)Cl,667.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(O)c(=O)cc2)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(CCCCCC)cc1)c1ccc(CCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,660.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc3c(c2)Sc2ccccc2N3CCCCCCCC)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClCCl,442.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc3c(c2)Sc2ccccc2N3CCCCCCCC)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccnc(C(=O)O)c1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClCCl,447.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(CCc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c1ccc2/C(N(c1ccc(CCCCCC)cc1)c1ccc(CCCCCC)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,CCO,643.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(-c2ccc(C(=O)O)cc2)c2nsnc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,453.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1nc2cc(O)c(O)cc2s1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,465.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c1cc1c2/C(=C2/C=CC(=N2)/C=3c2c(OCCCCCCCC)cccc2OCCCCCCCC)c2sc(-c3ccc(-c4ccc(C(=O)O)cc4)c4nsnc34)cc2C1(CCCC)CCCC,C1CCOC1,465.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(c2ccc(N(c3ccc(-c4ccc(CCCCCC)s4)cc3)c3ccc(-c4ccc(CCCCCC)s4)cc3)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)o1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,ClCCl,443.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(c2ccc(N(c3ccc(OCCCCCC)cc3)c3ccc(OCCCCCC)cc3)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(-c2ccc(C(=O)O)cc2)c2nn(CCCCCC)nc12)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,459.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1/C1=C2\C=CC(=N2)/C(c2ccc3c(c2)Sc2cc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)ccc2N3CCCCCCCC)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCCCC)cccc1OCCCCCCCC,C1CCOC1,447.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1C1=C2C(C)=C(C#Cc3ccc(C(=O)O)cc3)C(/C=C/c3ccc(CCCCCC)s3)=[N+]2[B-](C#CCOCCOC)(C#CCOCCOC)n2c(/C=C/c3ccc(CCCCCC)s3)c(-c3ccc(N(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c(C)c21,C1CCOC1,688.0
CCCCCCCCOc1cccc(OCCCCCCCC)c1C1=C2C(C)=C(C#Cc3ccc(C(=O)O)cc3)C(C)=[N+]2[B-](C#CCOCCOC)(C#CCOCCOC)n2c(C)c(-c3ccc(N(c4ccc(CCCCCC)cc4)c4ccc(CCCCCC)cc4)cc3)c(C)c21,C1CCOC1,553.0
CCCCCCCCOc1ccccc1/C1=C2\C=CC(=N2)/C(c2ccccc2OCCCCCCCC)=c2/cc/c3n2[Zn]n2c1ccc2/C(c1ccccc1OCCCCCCCC)=C1\N=C(C=C1C#Cc1ccc(/C=C(\C#N)C(=O)O)cc1)/C=3c1ccccc1OCCCCCCCC,C1CCOC1,605.0
CCCCCCCCOc1ccccc1N1c2ccc(/C=c3\s/c(=C4/SC(=S)N(CCCCCCCC)C4=O)n(CC(=O)O)c3=O)cc2C2CCCC21,ClC(Cl)Cl,545.0
CCCCCCCCOc1nc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc(-c2ccc3c4ccccc4n(CC)c3c2)c1C#N,ClCCl,409.0
CCCCCCCCOc1nc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)cc(-c2ccc3c4ccccc4n(CC)c3c2)c1C#N,ClCCl,475.0
CCCCCCCCOc1nc(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)s2)cc(-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)c1C#N,ClCCl,440.0
CCCCCCCCOc1nc(-c2ccc(-c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)s3)s2)cc(-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)c1C#N,ClCCl,475.0
CCCCCCCCSC1=C(SCCCCCCCC)SC(=Cc2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)s3)cc2)S1,C1CCOC1,429.0
CCCCCCCCSC1=C(SCCCCCCCC)SC(=Cc2ccc(-c3ccc4c(c3)Oc3cc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)ccc3N4CCCC)cc2)S1,C1CCOC1,431.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],C1COCCO1,397.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],CC#N,390.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],CCO,397.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],CCOC(C)=O,392.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],CO,399.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],CS(C)=O,401.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],Cc1ccccc1,402.0
CCCCCCCC[N+](C)(CCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1)CCCS(=O)(=O)[O-],ClC(Cl)Cl,402.0
CCCCCCCC[N+]1=C(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)C(C)(C)c2cc(C(=O)O)ccc21,CCO,552.0
CCCCCCCC[N+]1=C(/C=C2/C(=O)C(/C=C3/N(CC)c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,660.0
CCCCCCCC[N+]1=C(/C=C2/C(=O)C(/C=C3/N(CC)c4ccccc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CN(C)C=O,647.0
CCCCCCCC[N+]1=C(/C=C2/C(=O)C(C=C3N(CC)c4ccccc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,620.0
CCCCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(-c4ccc(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6cc(OCCCCCC)ccc6-7)c6ccc7c(c6)C(C)(C)c6cc(OCCCCCC)ccc6-7)cc5)s4)n3C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,672.0
CCCCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(-c4ccc(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6ccccc6-7)c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)s4)n3C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,C1CCOC1,669.0
CCCCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(-c4ccc(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6ccccc6-7)c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)s4)n3C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,669.0
CCCCCCCC[N+]1=C(/C=C2/C([O-])=C(/C=C3/N(CC)c4ccccc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2cc(C(=O)O)ccc21,CN(C)C=O,686.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=C3/N(CC)c4cc5ccccc5cc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,662.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=C3/N(CC)c4ccccc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CN(C)C=O,647.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=c3/c4cccc5c(C[C@H](CC)CCCC)ccc(c54)n3CCCCCC)=C2[O-])C(C)(C)c2c1ccc1cc(C(=O)O)ccc21,CCO,796.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=c3/c4cccc5c(N(CCCC)CCCC)ccc(c54)n3CCCCCC)=C2[O-])C(C)(C)c2c1ccc1cc(C(=O)O)ccc21,CCO,818.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=c3/c4cccc5c(N(C[C@@H](CC)CCCC)C[C@@H](CC)CCCC)ccc(c54)n3CCCCCC)=C2[O-])C(C)(C)c2c1ccc1cc(C(=O)O)ccc21,CCO,815.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=c3/c4cccc5c(OCCCC)ccc(c54)n3CCCCCC)=C2[O-])C(C)(C)c2c1ccc1cc(C(=O)O)ccc21,CCO,806.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=c3/c4cccc5cccc(c54)n3CCCCCC)=C2[O-])C(C)(C)c2c1ccc1cc(C(=O)O)ccc21,CCO,784.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(/C=c3/c4cccc5cccc(c54)n3CCCCCC)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,771.0
CCCCCCCC[N+]1=C(/C=C2\C(=O)C(C=C3N(CC)c4ccccc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,638.0
CCCCCCCC[N+]1=C(/C=C2\C([O-])=C(C=C3N(CCCCCCCO)c4ccc(C(=O)O)cc4C3(C)C)C2=C(C#N)C(=O)OCC)C(C)(C)c2cc(C(=O)O)ccc21,CN(C)C=O,703.0
CCCCCCCC[N+]1=C(/C=C2\C([O-])=C(C=C3N(CCCCCCCO)c4ccccc4C3(C)C)C2=C(C#N)C(=O)OCC)C(C)(C)c2cc(C(=O)O)ccc21,CN(C)C=O,695.0
CCCCCCCC[N+]1=C(C=C2C(=O)C(/C=C3/N(CC)c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,658.0
CCCCCCCC[N+]1=C(C=C2C(=O)C(C=C3N(C)c4ccccc4C3(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,637.0
CCCCCCCC[N+]1=C(C=C2C(=O)C(c3ccc(-c4ccc(-c5ccc6c(c5)Sc5cc(-c7ccc(OCC(CC)CCCC)cc7)ccc5N6CCCCCC)s4)s3)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,C1CCOC1,667.0
CCCCCCCC[NH+]1c2cc(C(=O)O)ccc2C(C)(C)C1C=C1C(=O)C(C=C2N(CC)c3ccccc3C2(C)C)=C1O,CCO,620.0
CCCCCCCC[NH+]1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2C(C)(C)[C@@H]1/C=C1\C(=O)[C@H](c2ccc(-c3ccc4c(c3)Sc3cc(OC[C@@H](CC)CCCC)ccc3N4CCCCCC)s2)[C@@H]1[O-],C1CCOC1,671.0
CCCCCCCC[NH+]1c2ccc(C(=O)O)cc2C(C)(C)[C@@H]1/C=C1\C(=O)[C@H](c2cc3sc(-c4ccc5c(c4)Sc4cc(OC[C@@H](CC)CCCC)ccc4N5CCCCCC)cc3s2)[C@@H]1[O-],C1CCOC1,662.0
CCCCCCCC[NH+]1c2ccc(C(=O)O)cc2C(C)(C)[C@@H]1/C=C1\C(=O)[C@H](c2ccc(-c3ccc(-c4ccc5c(c4)Sc4cc(OC[C@@H](CC)CCCC)ccc4N5CCCCCC)s3)s2)[C@@H]1[O-],C1CCOC1,667.0
CCCCCCCC[NH+]1c2ccc(C(=O)O)cc2C(C)(C)[C@@H]1/C=C1\C(=O)[C@H](c2ccc(-c3ccc4c(c3)Sc3cc(OC[C@@H](CC)CCCC)ccc3N4CCCCCC)s2)[C@@H]1[O-],C1CCOC1,653.0
CCCCCCCC[Si]1(CCCCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)s3)cc21,ClCCl,532.0
CCCCCCCC[Si]1(CCCCCCCC)c2cc(C#Cc3ccc(-n4c5ccccc5c5ccccc54)s3)sc2-c2sc(/C=C(\C#N)C(=O)O)cc21,C1CCOC1,450.0
CCCCCCCC[Si]1(CCCCCCCC)c2ccsc2-c2sc(/C=C(\C#N)C(=O)O)cc21,C1CCOC1,409.0
CCCCCCCC[n+]1ccc(-c2nc3sc(-c4cc[n+](CCCCCCCC)cc4)nc3s2)cc1,O,390.0
CCCCCCCCc1cc(-c2cc3c(s2)/C(=C2\C(=O)N(CC(CC)CCCC)c4cc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)ccc42)C(=O)N3CC(CC)CCCC)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,361.0
CCCCCCCCc1cc(-c2cc3c(s2)/C(=C2\C(=O)N(CC(CC)CCCC)c4cc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)sc42)C(=O)N3CC(CC)CCCC)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,405.0
CCCCCCCCc1cc(-c2cc3c(s2)/C(=C2\C(=O)N(CC(CC)CCCC)c4cc(-c5ccc(C=O)cc5)ccc42)C(=O)N3CC(CC)CCCC)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,358.0
CCCCCCCCc1cc(-c2ccc(-c3cc(CCCCCCCC)c(-c4ccc(-c5ccc(N(c6ccc(CCCCCC)cc6)c6ccc(CCCCCC)cc6)cc5)s4)s3)c3nsnc23)sc1-c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)s1,ClCCl,543.0
CCCCCCCCc1cc(-c2ccc(-c3cc(CCCCCCCC)c(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)c3nsnc23)sc1-c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)s1,ClCCl,534.0
CCCCCCCCc1cc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)c3nsnc23)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCO,470.0
CCCCCCCCc1cc(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)c3nsnc23)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,490.0
CCCCCCCCc1cc(-c2sc(-c3ccc(-c4cc(CCCCCCCC)c(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)s5)s4)c4nsnc34)cc2CCCCCCCC)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,529.0
CCCCCCCCc1cc(-c2sc(-c3ccc4c(c3)C(C)(C)c3cc(C=C(C#N)C(=O)O)ccc3-4)cc2CCCCCCCC)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,423.0
CCCCCCCCc1cc(-n2c3ccc(C(C)(C)C)cc3c3cc(C(C)(C)C)ccc32)sc1-c1cc2c(s1)-c1sc(/C=C(\C#N)C(=O)O)cc1C2(C)C,C1CCOC1,485.0
CCCCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc4c(c3)Sc3cc(-c5ccc(OCCCC)cc5)ccc3N4CC(CC)CCCC)cc2CCCCCCCC)s1,ClCCl,476.0
CCCCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3cc4c5c(c3)cc(-c3ccc(OCCCCCC)cc3)n5-c3ccccc3S4)cc2CCCCCCCC)s1,ClCCl,461.0
CCCCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3cc4c5cc(OC)ccc5n([C@@H](CC)CCCCC)c4c4ccccc34)cc2CCCCCCCC)s1,ClCCl,477.0
CCCCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc4c(c3)Sc3cc(-c5ccc(OCCCC)cc5)ccc3N4CC(CC)CCC)cc2CCCCCCCC)s1,ClCCl,476.0
CCCCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc4c(c3)Sc3ccccc3N4CC(CC)CCC)cc2CCCCCCCC)s1,ClCCl,488.0
CCCCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3cc4c5cc(OC)ccc5n(C(CC)CCCCC)c4c4ccccc34)cc2CCCCCCCC)s1,ClCCl,477.0
CCCCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1nc2sc(-c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4)s3)nc2s1,C1CCOC1,485.0
CCCCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1nc2sc(-c3ccc(-c4ccc(N(c5ccc(OCCCC)cc5)c5ccc(OCCCC)cc5)cc4)s3)nc2s1,C1CCOC1,486.0
CCCCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1nc2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)nc2s1,C1CCOC1,474.0
CCCCCCCCc1cc2c3cc(CCCCCCCC)sc3c3nc4c(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c4nc3c2s1,ClC(Cl)Cl,586.0
CCCCCCCCc1ccc(-c2c3cc(-c4cc(CCCCCCCC)c(-c5ccc(-c6sc(/C=C7\SC(=S)N(CC)C7=O)cc6CCCCCCCC)s5)s4)sc3c(-c3ccc(CCCCCCCC)s3)c3cc(-c4cc(CCCCCCCC)c(-c5ccc(-c6sc(/C=C7\SC(=S)N(CC)C7=O)cc6CCCCCCCC)s5)s4)sc23)s1,ClC(Cl)Cl,509.0
CCCCCCCCc1ccc(-c2c3cc(-c4cc(CCCCCCCC)c(-c5ccc(-c6sc(/C=C7\SC(N8CCCCC8)=NC7=O)cc6CCCCCCCC)s5)s4)sc3c(-c3ccc(CCCCCCCC)s3)c3cc(-c4cc(CCCCCCCC)c(-c5ccc(-c6sc(/C=C7\SC(N8CCCCC8)=NC7=O)cc6CCCCCCCC)s5)s4)sc23)s1,ClC(Cl)Cl,475.0
CCCCCCCCc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(CCCCCCCC)s5)c5nsnc45)c4ccc5c(-c6ccc(-c7ccc(CCCCCCCC)s7)c7nsnc67)cc(-c6ccc(-c7ccc(CCCCCCCC)s7)c7nsnc67)c6ccc3c4c65)c3nsnc23)s1,ClC(Cl)Cl,452.0
CCCCCCCCc1ccc(-c2nc3c(-c4ccc(/C=C(/C#N)C(=O)O)cc4)ccc(-c4cc(CCCCCCCC)c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c3nc2-c2ccc(CCCCCCCC)s2)s1,ClCCl,438.0
CCCCCCCCc1ccc(-c2nc3c(-c4ccc(/C=C(/C#N)C(=O)O)cc4)sc(-c4cc(CCCCCCCC)c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c3nc2-c2ccc(CCCCCCCC)s2)s1,ClCCl,605.0
CCCCCCCCc1ccc(-c2nc3c(-c4ccc(/C=C(\C#N)C(=O)O)cc4)ccc(-c4cc(CCCCCCCC)c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c3nc2-c2ccc(CCCCCCCC)s2)s1,ClCCl,438.0
CCCCCCCCc1ccc(-c2nc3c(-c4ccc(/C=C(\C#N)C(=O)O)cc4)sc(-c4cc(CCCCCCCC)c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c3nc2-c2ccc(CCCCCCCC)s2)s1,ClCCl,605.0
CCCCCCCCc1ccc(-c2nc3c4cc(-c5ccc(/C=C(/C#N)C(=O)O)cc5)sc4c4sc(-c5cc(CCCCCCCC)c(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)cc4c3nc2-c2ccc(CCCCCCCC)s2)s1,ClCCl,400.0
CCCCCCCCc1ccc(-c2nc3c4cc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)sc4c4sc(-c5cc(CCCCCCCC)c(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)cc4c3nc2-c2ccc(CCCCCCCC)s2)s1,ClCCl,400.0
CCCCCCCCc1ccc(-n2c3c(c4c2c2c(n4-c4ccc(CCCCCCCC)cc4)-c4ccccc4NB2c2ccccc2)B(c2ccccc2)Nc2ccccc2-3)cc1,Cc1ccccc1,387.0
CCCCCCCCc1ccc(-n2c3c4ccccc4nc(-c4ccc(C#N)cc4)c3c3c2c2c(-c4ccc(C#N)cc4)nc4ccccc4c2n3-c2ccc(CCCCCCCC)cc2)cc1,ClC(Cl)Cl,314.0
CCCCCCCCc1ccc(-n2c3c4ccccc4nnc3c3c2c2nnc4ccccc4c2n3-c2ccc(CCCCCCCC)cc2)cc1,Cc1ccccc1,316.0
CCCCCCCCc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(CCCCCCCC)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(CCCCCCCC)cc2)=C2/C=C(/C=C/C=C(C(=O)O)C(=O)O)C(=N2)/C=4c2ccc(CCCCCCCC)cc2)cc1,CN(C)C=O,612.0
CCCCCCCCc1ccc(C2(c3ccc(CCCCCCCC)cc3)c3cc4c(cc3-c3cc5c(cc32)-c2cc3c(cc2C5(c2ccc(CCCCCCCC)cc2)c2ccc(CCCCCCCC)cc2)-c2ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc2C3(CCCCCCCC)CCCCCCCC)Cc2cc(/C=C(\C#N)C(=O)O)ccc2-4)cc1,ClCCl,457.0
CCCCCCCCc1ccc(C2(c3ccc(CCCCCCCC)cc3)c3cc4c(cc3-c3cc5c(cc32)-c2cc3c(cc2C5(c2ccc(CCCCCCCC)cc2)c2ccc(CCCCCCCC)cc2)-c2ccc(N(c5ccc(N(C)C)cc5)c5ccc(N(C)C)cc5)cc2C3(CCCCCCCC)CCCCCCCC)Cc2cc(/C=C(\C#N)C(=O)O)ccc2-4)cc1,ClCCl,444.0
CCCCCCCCc1ccc(C2(c3ccc(CCCCCCCC)cc3)c3cc4c(cc3-c3cc5c(cc32)-c2cc3c(cc2C5(c2ccc(CCCCCCCC)cc2)c2ccc(CCCCCCCC)cc2)-c2ccc(N5c6ccccc6Sc6ccccc65)cc2C3(CCCCCCCC)CCCCCCCC)Cc2cc(/C=C(\C#N)C(=O)O)ccc2-4)cc1,ClCCl,442.0
CCCCCCCCc1ccc(N(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)c(OC)c(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2cc(C(C)(C)C)c(OC)c(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4C#Cc2ccc(C(=O)O)cc2)c2ccc(CCCCCCCC)cc2)cc1,C1CCOC1,662.0
CCCCCCCCc1ccc(N(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4C#Cc2c3ccccc3c(/C=C(\C#N)C(=O)O)c3ccccc23)c2ccc(CCCCCCCC)cc2)cc1,C1CCOC1,661.0
CCCCCCCCc1ccc(N(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4C#Cc2c3ccccc3c(C(=O)O)c3ccccc23)c2ccc(CCCCCCCC)cc2)cc1,C1CCOC1,661.0
CCCCCCCCc1ccc(N(/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4C#Cc2ccc(/C=C(\C#N)C(=O)O)c3ccccc23)c2ccc(CCCCCCCC)cc2)cc1,C1CCOC1,657.0
CCCCCCCCc1ccc(N(/C2=C3\C=CC(=N3)/C(c3ccc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc2)=C2/C=CC(=N2)/C=4C#Cc2ccc(C(=O)O)cc2)c2ccc(CCCCCCCC)cc2)cc1,C1CCOC1,666.0
CCCCCCCCc1ccc(N(c2ccc(CCCCCCCC)cc2)c2ccc(-c3ccc(C4=C5C(=O)N(CCCCCCCC)C(c6ccc(-c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)c(-c8ncc(C=C(C(=O)O)C(=O)O)s8)s7)s6)=C5C(=O)N4CCCCCCCC)s3)cc2)cc1,C1CCOC1,640.0
CCCCCCCCc1ccc(N(c2ccc(CCCCCCCC)cc2)c2ccc(-c3ccc(C4=C5C(=O)N(Cc6c(OCC(CC)CCCC)cccc6OCC(CC)CCCC)C(c6ccc(-c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)c(-c8ncc(C=C(C(=O)O)C(=O)O)s8)s7)s6)=C5C(=O)N4Cc4c(OCC(CC)CCCC)cccc4OCC(CC)CCCC)s3)cc2)cc1,C1CCOC1,642.0
CCCCCCCCc1ccc(N(c2ccc(CCCCCCCC)cc2)c2ccc3c(c2)/C=N/c2ccc(C(=O)O)cc2/N=C/c2cc(N(c4ccc(CCCCCCCC)cc4)c4ccc(CCCCCCCC)cc4)ccc2O[Zn]O3)cc1,C1CCOC1,470.0
CCCCCCCCc1ccc2c(c1)-c1ccc(N(c3ccc(-c4ccc(-c5ccc(C6=C([O-])/C(=C\C7=[N+](CCCCCCCC)c8ccc(C(=O)O)cc8C7(C)C)C6=O)n5C)s4)cc3)c3ccc4c(c3)C(C)(C)c3cc(CCCCCCCC)ccc3-4)cc1C2(C)C,C1CCOC1,672.0
CCCCCCCCc1cccc(CCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)c(O)c1)=C1/C=CC(=N1)/C=3c1c(CCCCCCCC)cccc1CCCCCCCC,C1CCOC1,448.0
CCCCCCCCc1cccc(CCCCCCCC)c1/C1=C2\C=CC(=N2)/C(N(c2ccc(CCCCCC)cc2)c2ccc(CCCCCC)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(CCCCCCCC)cccc1CCCCCCCC,C1CCOC1,447.0
CCCCCCCCc1ccsc1-c1cc(CCCCCCCC)c(-c2cc(CCCCCCCC)c(-c3ccc(-c4sc(-c5sc(-c6sc(C=C(C#N)C(=O)O)cc6CCCCCCCC)cc5CCCCCCCC)cc4CCCCCCCC)s3)s2)s1,ClCCl,457.0
CCCCCCCCc1ccsc1-c1cc(CCCCCCCC)c(-c2ccc(-c3sc(-c4sc(C=C(C#N)C(=O)O)cc4CCCCCCCC)cc3CCCCCCCC)s2)s1,ClCCl,479.0
CCCCCCCCc1ccsc1-c1ccc(-c2sc(-c3ccc(-c4cc(CCCCCCCC)c(-c5ccc(-c6sc(C=C(C#N)C(=O)O)cc6CCCCCCCC)s5)s4)s3)cc2CCCCCCCC)s1,ClCCl,453.0
CCCCCCCCc1ccsc1-c1ccc(-c2sc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2CCCCCCCC)s1,ClCCl,480.0
CCCCCCCCc1nc2c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2nc1CCCCCCC,ClC(Cl)Cl,516.0
CCCCCCCCc1nc2c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)sc3c3sc(-c4ccc(-c5ccc6c(c5)C5CCCC5N6c5ccc(C)cc5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)cc3c2nc1CCCCCCCC,C1CCOC1,504.0
CCCCCCCCc1nc2c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)sc3c3sc(-c4ccc(-c5ccc6c(c5)C5CCCC5N6c5ccc(C)cc5)c5nc6c7ccccc7c7ccccc7c6nc45)cc3c2nc1CCCCCCCC,C1CCOC1,467.0
CCCCCCCCc1nc2cc(C(=O)OC)ccn2c1NC1CCCCC1,CS(C)=O,368.0
CCCCCCCCn1c(-c2ccc(C3=C(C)C4=C(CCCCC)c5c(C)c(C=C(C#N)C(=O)O)c(C)n5[B-](F)(F)[N+]4=C3C)s2)nc2c3ccc(OC)cc3c3cc(OC)ccc3c21,ClC(Cl)Cl,532.0
CCCCCCCCn1c(-c2ccc(C3=C(C)C4=C(CCCCCC)c5c(C)c(C=C(C#N)C(=O)O)c(C)n5[B-](F)(F)[N+]4=C3C)s2)nc(-c2ccc(OC)cc2)c1-c1ccc(OC)cc1,ClC(Cl)Cl,532.0
CCCCCCCCn1c(=C(C#N)C#N)s/c(=c2/c(=C\c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc5c(c4)C(C)(C)c4ccccc4-5)s3)sc(=O)n2CC(=O)O)c1=O,ClC(Cl)Cl,567.0
CCCCCCCCn1c(=C(C#N)C#N)s/c(=c2/c(=C\c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc5c(c4)C(CCCC)(CCCC)c4ccccc4-5)s3)sc(=O)n2CCCCCCCC)c1=O,ClC(Cl)Cl,557.0
CCCCCCCCn1c(=C(C#N)C#N)s/c(=c2/c(=C\c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc5c(c4)C(CCCCCCCC)(CCCCCCCC)c4ccccc4-5)s3)sc(=O)n2CC(=O)O)c1=O,ClC(Cl)Cl,568.0
CCCCCCCCn1c(=C(C#N)C#N)s/c(=c2/c(=C\c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc5c(c4)Cc4ccccc4-5)s3)sc(=O)n2CC(=O)O)c1=O,ClC(Cl)Cl,566.0
CCCCCCCCn1c(=C(C#N)C#N)s/c(=c2/s/c(=C\c3ccc4c(c3)C3CCCC3N4c3ccc4c(c3)C(CCCC)(CCCC)c3ccccc3-4)c(=O)n2CC(=O)O)c1=O,ClC(Cl)Cl,566.0
CCCCCCCCn1c(=O)/c(=C/c2ccc(-c3ccc4c(c3)[C@H]3CCC[C@H]3N4c3ccc4c(c3)c3ccccc3n4CCCCC)s2)s/c1=C(/C#N)C(=O)O,CO,512.0
CCCCCCCCn1c(=O)/c(=C/c2ccc(N3c4ccccc4C4CCCC43)s2)s/c1=C(/C#N)C(=O)O,ClC(Cl)Cl,550.0
CCCCCCCCn1c(=O)/c(=C\c2ccc(-c3ccc4c(c3)[C@H]3CCC[C@H]3N4c3ccc4c(c3)c3ccccc3n4CCCCC)cc2)s/c1=C(/C#N)C(=O)O,CO,454.0
CCCCCCCCn1c(=O)/c(=c2\c(=Cc3ccc4c(c3)C3CCCC3N4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)sc(=O)n2CC(=O)O)s/c1=C1/SC(=S)N(c2ccccc2)C1=O,ClC(Cl)Cl,570.0
CCCCCCCCn1c(=O)/c(=c2\s/c(=C\c3ccc4c(c3)C3CCCC3N4c3ccc4c(c3)C(CCCC)(CCCC)c3ccccc3-4)c(=O)n2CC(=O)O)s/c1=C(/C#N)C(=O)O,ClC(Cl)Cl,558.0
CCCCCCCCn1c(=O)/c(=c2\s/c(=C\c3ccc4c(c3)C3CCCC3N4c3ccc4c(c3)C(CCCC)(CCCC)c3ccccc3-4)c(=O)n2CCCCCCCC)s/c1=C(/C#N)C(=O)O,ClC(Cl)Cl,557.0
CCCCCCCCn1c(=O)c2cc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4cc5c(=O)n(CCCCCCCC)c(=O)c5cc4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3cc2c1=O,ClC(Cl)Cl,479.0
CCCCCCCCn1c(=O)c2cc3c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)c4cc5c(=O)n(CCCCCCCC)c(=O)c5cc4c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)c3cc2c1=O,ClC(Cl)Cl,582.0
CCCCCCCCn1c(=O)c2cc3cc4cc5c(=O)n(CCCCCCCC)c(=O)c5cc4c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3cc2c1=O,ClC(Cl)Cl,427.0
CCCCCCCCn1c(=O)c2cc3cc4cc5c(=O)n(CCCCCCCC)c(=O)c5cc4c(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)c3cc2c1=O,ClC(Cl)Cl,515.0
CCCCCCCCn1c(C=C(C#N)C(=O)O)ccc1-c1ccc(-c2ccc(-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)s2)c2nsnc12,ClCCl,517.0
CCCCCCCCn1c2c(c3ccccc31)-c1c(c3ccccc3n1CCCCCCCC)-c1c(c3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc3n1CCCCCCCC)-c1c-2c2ccccc2n1CCCCCCCC,ClCCl,474.0
CCCCCCCCn1c2c(c3ccccc31)-c1c(c3ccccc3n1CCCCCCCC)-c1c(c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3n1CCCCCCCC)-c1c-2c2ccccc2n1CCCCCCCC,ClCCl,460.0
CCCCCCCCn1c2cc(-c3cccs3)ccc2c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3F)cc21,ClCCl,357.0
CCCCCCCCn1c2cc(C=C(C#N)C(=O)O)sc2c2sc(-c3ccc(-c4ccc5c(c4)c4c(n5CCCCCC)-c5ccccc5C45c4ccccc4-c4ccccc45)c4nsnc34)cc21,ClCCl,545.0
CCCCCCCCn1c2cc(C=C(C#N)C(=O)O)sc2c2sc(-c3ccc4c(c3)c3c(n4CCCCCC)-c4ccccc4C34c3ccccc3-c3ccccc34)cc21,ClCCl,529.0
CCCCCCCCn1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc21,C1CCOC1,471.5
CCCCCCCCn1c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)c(F)c3F)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)c(F)c3F)ccc21,ClC(Cl)Cl,401.0
CCCCCCCCn1c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(-c2ccc(C=C(C#N)C(=O)O)o2)ccc1n3CCCCCCCC,C1CCOC1,539.0
CCCCCCCCn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(-c2ccc(C=C(C#N)C(=O)O)o2)ccc1n3CCCCCCCC,C1CCOC1,534.0
CCCCCCCCn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,ClCCl,468.0
CCCCCCCCn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,442.0
CCCCCCCCn1c2ccc(/C=C(/C#N)C(=O)O)cc2c2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c(c5)c5cc(/C=C(/C#N)C(=O)O)ccc5n6CCCCCCC)cc4)c4ccc(/C=C/c5ccc6c(c5)c5cc(/C=C(\C#N)C(=O)O)ccc5n6CCCCCCC)cc4)cc3)ccc21,ClCCl,405.0
CCCCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2cc(-c3c(C)cc(C)cc3C)ccc21,ClC(Cl)Cl,413.0
CCCCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2cc(-c3ccc(N(c4ccc(-c5ccc6c(c5)c5cc(C=C(C#N)C(=O)O)ccc5n6CCCCCCCC)cc4)c4ccc(C)cc4C)cc3)ccc21,ClC(Cl)Cl,403.0
CCCCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2cc(-c3ccc(OC)cc3)ccc21,ClC(Cl)Cl,418.0
CCCCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2cc(-c3ccccc3)ccc21,ClC(Cl)Cl,414.0
CCCCCCCCn1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2c2cc(-c3ccc(C(C)(C)C)cc3)ccc21,ClC(Cl)Cl,456.0
CCCCCCCCn1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2c2cc(-c3ccccc3)ccc21,ClC(Cl)Cl,454.0
CCCCCCCCn1c2ccc(C=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(-c2ccc(C=C(C#N)C(=O)O)o2)ccc1n3CCCCCCCC,C1CCOC1,540.0
CCCCCCCCn1c2ccccc2c(=O)c2ccccc21,CS(C)=O,404.0
CCCCCCCCn1c2ccccc2c2c(-c3ccc(CC)cc3)c3c(c(-c4ccc(CC)cc4)c21)c1cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)ccc1n3CCCCCCCC,ClCCl,476.0
CCCCCCCCn1c2ccccc2c2c(-c3ccc(N(CC)CC)cc3)c3c(c(-c4ccc(N(CC)CC)cc4)c21)c1cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)ccc1n3CCCCCCCC,ClCCl,500.0
CCCCCCCCn1c2ccccc2c2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc3sc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)cc3c21,ClC(Cl)Cl,492.0
CCCCCCCCn1c2ccccc2c2c(-c3ccc(OCC)cc3)c3c(c(-c4ccc(OCC)cc4)c21)c1cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)ccc1n3CCCCCCCC,ClCCl,505.0
CCCCCCCCn1c2ccccc2c2c(-c3ccccc3)cc3cc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)sc3c21,ClC(Cl)Cl,476.0
CCCCCCCCn1c2ccccc2c2c(-c3ccccc3)cc3sc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)cc3c21,ClC(Cl)Cl,486.0
CCCCCCCCn1c2ccccc2c2c1c1c3ccccc3n(CCCCCCCC)c1c1c3cc(-c4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)ccc3n(CCCCCCCC)c21,ClCCl,464.0
CCCCCCCCn1c2ccccc2c2c1c1c3ccccc3n(CCCCCCCC)c1c1c3cc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)c5nsnc45)ccc3n(CCCCCCCC)c21,ClCCl,497.0
CCCCCCCCn1c2ccccc2c2c1c1c3ccccc3n(CCCCCCCC)c1c1c3cc(C#Cc4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)ccc3n(CCCCCCCC)c21,ClCCl,469.0
CCCCCCCCn1c2ccccc2c2c1c1c3ccccc3n(CCCCCCCC)c1c1c3cc(C#Cc4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)c5nsnc45)ccc3n(CCCCCCCC)c21,ClCCl,481.0
CCCCCCCCn1c2ccccc2c2c3c(ccc21)ccc1c3c2cc(/C=C(\C#N)C(=O)O)ccc2n1CCCCCCCC,ClC(Cl)Cl,435.0
CCCCCCCCn1c2ccccc2c2cc(-c3cc4nc5c6cccnc6c6ncccc6c5nc4cc3-c3ccc4c(c3)c3ccccc3n4CCCCCCCC)ccc21,ClCCl,440.0
CCCCCCCCn1c2ccccc2c2cc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5CCCCCCCC)c4nc5c6cccnc6c6ncccc6c5nc34)ccc21,ClCCl,473.0
CCCCCCCCn1c2ccccc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)cc3F)ccc21,ClCCl,393.0
CCCCCCCCn1c2ccccc2c2cc(/C=C/c3cc(C)c4n3[B-](F)(F)[N+]3=C(/C=C/c5ccc6c7ccccc7n(CCCCCCCC)c6c5)C=C(C)C3=C4c3ccc(C(=O)O)cc3)ccc21,ClCCl,504.0
CCCCCCCCn1c2ccccc2c2cc(C3=C(C)C4=C(CCCCC)c5c(C)c(/C=C(\C#N)C(=O)O)c(C)n5[B-](F)(F)[N+]4=C3C)ccc21,ClC(Cl)Cl,531.0
CCCCCCCCn1c2ccccc2c2cc(C3=C(C)C4=C(CCCCC)c5c(C)c(C=C(C#N)C(=O)O)c(C)n5[B-](F)(F)[N+]4=C3C)ccc21,ClC(Cl)Cl,531.0
CCCCCCCCn1c2ccccc2c2cc(C=C(C#N)C(=O)O)ccc21,ClC(Cl)Cl,408.0
CCCCCCCCn1c2ccccc2c2cc(N3c4ccccc4Sc4cc(/C=C(\C#N)C(=O)O)ccc43)ccc21,ClCCl,480.0
CCCCCCCCn1c2ccccc2c2cc(N3c4ccccc4Sc4cc(/C=C5\SC(=S)N(CC(=O)O)C5=O)ccc43)ccc21,ClCCl,500.0
CCCCCCCCn1c2ccccc2c2cc3c(cc21)c1cc(-c2cc(CCCCCC)c(-c4cc(CCCCCC)c(-c5cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s5)s4)s2)ccc1n3CCCCCCCC,Cc1ccccc1,501.0
CCCCCCCCn1c2ccccc2c2cc3c(cc21)c1cc(-c2cc(CCCCCC)c(-c4cc(CCCCCC)c(C=C(C#N)C(=O)O)s4)s2)ccc1n3CCCCCCCC,Cc1ccccc1,492.0
CCCCCCCCn1c2ccccc2c2ccc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c7ccccc7n(CCCCCCCC)c6c5)cc4)c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)cc21,C1CCOC1,395.0
CCCCCCCCn1c2ccccc2c2ccc(C3=C(C)C4=C(CCCCC)c5c(C)c(/C=C(\C#N)C(=O)O)c(C)n5[B-](F)(F)[N+]4=C3C)cc21,ClC(Cl)Cl,530.0
CCCCCCCCn1c2ccccc2c2ccc(C3=C(C)C4=C(CCCCC)c5c(C)c(C=C(C#N)C(=O)O)c(C)n5[B-](F)(F)[N+]4=C3C)cc21,ClC(Cl)Cl,530.0
CCCCCCCCn1cc(-n2c(-c3cc(-c4nc5ccc(C)cc5n4-c4cn(CCCCCCCC)nn4)cc(-c4nc5ccc(C)cc5n4-c4cn(CCCCCCCC)nn4)c3)nc3ccc(C)cc32)nn1,ClCCl,309.5
CCCCCCCCn1nc2c(-c3ccc(/C=C(/C#N)C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4ccc(N5c6ccccc6C6C7CCC(C7)C65)cc4)s3)c2n1,ClCCl,641.0
CCCCCCCCn1nc2c(-c3ccc(/C=C(/C#N)C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4cccc5c4C4C6CCC(C6)C4N5c4ccccc4)s3)c2n1,ClCCl,669.0
CCCCCCCCn1nc2c(-c3ccc(/C=C(/C#N)C(=O)O)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4ccc(N5c6ccccc6C6C7CCC(C7)C65)cc4)s3)c2n1,ClCCl,604.0
CCCCCCCCn1nc2c(-c3ccc(/C=C(\C#N)C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(N4c5ccccc5C5C6CCC(C6)C54)cc3)c2n1,ClCCl,575.0
CCCCCCCCn1nc2c(-c3ccc(/C=C(\C#N)C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3cccc4c3C3C5CCC(C5)C3N4c3ccccc3)c2n1,ClCCl,602.0
CCCCCCCCn1nc2c(-c3ccc(/C=C(\C#N)C(=O)O)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c2n1,ClCCl,592.0
CCCCCCCCn1nc2c(-c3ccc(/C=C(\C#N)C(=O)O)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4cccc5c4C4C6CCC(C6)C4N5c4ccccc4)s3)c2n1,ClCCl,630.0
CCCCCCCCn1nc2c(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc(-c3ccc(-c4ccc5c(c4)c4c(-c6ccccc6)c6c(c(-c7ccccc7)c4n5CCCCCC)c4ccccc4n6CCCCCC)s3)c2n1,C1CCOC1,429.0
CCCCCCCCn1nc2c(-c3ccc(C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c2n1,ClCCl,595.0
CCCCCCCCn1nc2c(-c3ccc(C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4ccc(N5c6ccccc6C6C7CCC(C7)C65)cc4)s3)c2n1,ClCCl,617.0
CCCCCCCCn1nc2c(-c3ccc(C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4cccc5c4C4C6CCC(C6)C4N5c4ccccc4)s3)c2n1,ClCCl,644.0
CCCCCCCCn1nc2c(-c3ccc(C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2n1,ClCCl,714.0
CCCCCCCCn1nc2c(-c3ccc(C(=O)O)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c2n1,ClCCl,578.0
CCCCCCCCn1nc2c(-c3ccc(C(=O)O)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(-c4ccc(N5c6ccccc6C6C7CCC(C7)C65)cc4)s3)c2n1,ClCCl,589.0
CCCCCCCCn1nc2c(-c3ccc(C=C(C#N)C(=O)O)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2n1,ClCCl,558.0
CCCCCCCCn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2n1,ClCCl,520.0
CCCCCCCCn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(C(=O)O)s3)c2n1,ClCCl,511.0
CCCCCCCCn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc(-c3ccc(C=C(C#N)C(=O)O)o3)c2n1,ClCCl,458.0
CCCCCCCCn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc(-c3ccc(C=C(C#N)C(=O)O)s3)c2n1,ClCCl,454.0
CCCCCCCCn1nc2c(-c3ccc(N4c5ccccc5C5C6CCC(C6)C54)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2n1,ClCCl,546.0
CCCCCCCCn1nc2c(-c3ccc(N4c5ccccc5C5C6CCC(C6)C54)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc3c(-c3ccc(C(=O)O)s3)c2n1,ClCCl,529.0
CCCCCCCCn1nc2c(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)ccc(-c3cc4c(s3)C(C)(C)c3cc(/C=C(\C#N)C(=O)O)sc3-4)c2n1,ClCCl,514.0
CCCCCCCCn1nc2c(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)ccc(-c3cc4c(s3)C(CCCCCCCC)(CCCCCCCC)c3cc(/C=C(\C#N)C(=O)O)sc3-4)c2n1,ClCCl,514.0
CCCCCCCCn1nc2c(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2n1,ClCCl,495.0
CCCCCCCCn1nc2c(-c3ccc4c(c3)[C@H]3CCC[C@H]3N4c3ccc(C)cc3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2n1,ClCCl,496.0
CCCCCCCCn1nc2c(-c3ccc4c(c3)c3cccc5c3n4-c3ccccc3C5(CC)CC)ccc(-c3cc4sc(/C=C(\C#N)C(=O)O)cc4s3)c2n1,C1CCOC1,444.0
CCCCCCCCn1nc2c(-c3ccc4c(c3)c3cccc5c3n4-c3ccccc3C5(CC)CC)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2n1,C1CCOC1,431.0
CCCCCCCCn1nc2c(-c3ccc4c(c3)c3ccccc3n4-c3ccc(C)cc3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c2n1,C1CCOC1,500.0
CCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,C1CCOC1,428.0
CCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,Cc1ccccc1,428.0
CCCCCCCCn1nnc(-c2ccc(C#Cc3ccc(C#Cc4ccc(-c5nnn(CCCCCCCC)n5)cc4)c4nc5c6ccccc6c6ccccc6c5nc34)cc2)n1,ClCCl,428.0
CCCCCCCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CCCCCCC)c4ccc(C5=C([O-])/C(=C\C6=[N+](CCCC)c7ccc(C(=O)O)cc7C6(C)C)C5=O)cc4C3(C)C)C2=O)C(C)(C)c2cc(C3=C([O-])C(=Cc4sc5ccccc5[n+]4CCCC)C3=O)ccc21,ClC(Cl)Cl,848.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,C1COCCO1,689.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,CCO,673.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,CN(C)C=O,681.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,ClC(Cl)Cl,685.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)Sc2ccccc21,C1COCCO1,694.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)Sc2ccccc21,CCO,681.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)Sc2ccccc21,CN(C)C=O,681.0
CCCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCCC)c4ccccc4C3(C)C)C2=C(C#N)C#N)Sc2ccccc21,ClC(Cl)Cl,690.0
CCCCCCCN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3CCCCCCC)C2=C(C#N)C#N)Sc2ccccc21,C1COCCO1,709.0
CCCCCCCN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3CCCCCCC)C2=C(C#N)C#N)Sc2ccccc21,CCO,696.0
CCCCCCCN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3CCCCCCC)C2=C(C#N)C#N)Sc2ccccc21,CN(C)C=O,696.0
CCCCCCCN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3CCCCCCC)C2=C(C#N)C#N)Sc2ccccc21,ClC(Cl)Cl,704.0
CCCCCCCc1cc2c(o1)=CC1=C3c4cc5oc(CCCCCCC)cc5n4[B-](F)(F)[n+]4nnn(c43)[B-](F)(F)[N+]=21,C1CCOC1,676.0
CCCCCCCc1cc2c(o1)=CC1=C3c4cc5oc(CCCCCCC)cc5n4[B-](F)(F)[n+]4nnn(c43)[B-](F)(F)[N+]=21,ClCCl,685.0
CCCCCCCc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,426.0
CCCCCCCc1ccc(C2=[N+]3C(=C4c5cc(OCC(CC)CC)c(-c6ccc(CCCCCCC)o6)n5[B-](F)(F)[n+]5c4n(c4cc(C(C)(C)C)ccc45)[B-]3(F)F)C=C2OCC(CC)CC)o1,C1CCOC1,816.0
CCCCCCCc1ccc(C2=[N+]3C(=C4c5cc(OCC(CC)CC)c(-c6ccc(CCCCCCC)o6)n5[B-](F)(F)[n+]5c4n(c4cc(C(C)(C)C)ccc45)[B-]3(F)F)C=C2OCC(CC)CC)o1,ClCCl,826.0
CCCCCCCn1/c(=C\C2C(=O)C(=CC3=[N+](CCCC)c4ccc(C(=O)O)cc4C3(C)C)C2[O-])c2cccc3cccc1c32,CCO,782.0
CCCCCCCn1c2cc(/C=C(\C#N)C(=O)O)sc2c2sc(-c3cc4c(s3)c3sc(CCCCCC)cc3n4-c3ccc(OCCCCCC)cc3)cc21,ClCCl,512.0
CCCCCCCn1c2ccc(/C=C(/C#N)C(=O)O)cc2c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccc(/C=C/c5ccc6c(c5)c5cc(/C=C(\C#N)C(=O)O)ccc5n6CCCCCCC)cc4)cc3)ccc21,ClCCl,400.0
CCCCCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2ccc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc6c7cc(/C=C(\C#N)C(=O)O)ccc7n(CCCCCCC)c6c5)cc4)c4ccc(/C=C/c5ccc6c7cc(/C=C(\C#N)C(=O)O)ccc7n(CCCCCCC)c6c5)cc4)cc3)cc21,ClCCl,402.0
CCCCCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccc(/C=C/c5ccc6c7cc(/C=C(\C#N)C(=O)O)ccc7n(CCCCCCC)c6c5)cc4)cc3)cc21,ClCCl,397.0
CCCCCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,423.0
CCCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,423.0
CCCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2ccc(/C=C\c3ccc(N(c4ccccc4)c4ccc(/C=C/c5ccc6c7cc(C=C(C#N)C(=O)O)ccc7n(CCCCCCC)c6c5)cc4)cc3)cc21,ClCCl,397.0
CCCCCCN(CCCCCC)c1cc2c(C#Cc3ccc(/C=C(/C#N)C(=O)O)cc3)c3oc(N(CCCCCC)CCCCCC)cc3c(C#Cc3ccc(/C=C(/C#N)C(=O)O)cc3)c2o1,C1CCOC1,516.0
CCCCCCN(CCCCCC)c1ccc(-n2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc5c(c4)C4CCCC4N5c4ccc5c(c4)C(CCC)(CCC)c4ccccc4-5)cc32)cc1,ClCCl,536.0
CCCCCCN(CCCCCC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1,CC#N,480.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2c(F)c(F)c(F)c(F)c2F)cc1,CO,357.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2c(F)c(F)c(F)c(F)c2F)cc1,ClCCl,363.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccc(N(CCCCCC)CCCCCC)cc4)cc3)cc2)cc1,Cc1ccccc1,374.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(/C=C/c3ccc(-c4ccc(/C=C/c5ccc(C#Cc6ccc(N(CCCCCC)CCCCCC)cc6)cc5)cc4)cc3)cc2)cc1,Cc1ccccc1,400.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(C#Cc3ccc(-c4ccc(C#Cc5ccc(C#Cc6ccc(N(CCCCCC)CCCCCC)cc6)cc5)cc4)cc3)cc2)cc1,Cc1ccccc1,381.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CC#N,379.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CO,378.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(C#N)cc2)cc1,ClCCl,385.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(C(F)(F)F)cc2)cc1,CO,356.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(C(F)(F)F)cc2)cc1,ClCCl,362.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(N(CCCCCC)CCCCCC)cc2)cc1,CO,380.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc(N(CCCCCC)CCCCCC)cc2)cc1,ClCCl,387.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc([N+](=O)[O-])cc2)cc1,CO,417.0
CCCCCCN(CCCCCC)c1ccc(C#Cc2ccc([N+](=O)[O-])cc2)cc1,ClCCl,431.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,C1CCOC1,455.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CC#N,460.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CC(O)CO,462.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CCCCCC,445.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CCCO,456.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CCO,454.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CN(C)C=O,464.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CO,457.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,CS(C)=O,467.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,Cc1ccccc1,451.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,ClC(Cl)Cl,459.0
CCCCCCN(CCCCCC)c1ccc2cc3cc(C#N)ccc3cc2c1,OCCO,464.0
CCCCCCN(c1ccc(/C=C(\C#N)C(=O)O)cc1)c1ccc(/C=C(\C#N)c2ccc(/C=C(/C#N)C(=O)O)s2)cc1,ClC(Cl)Cl,418.0
CCCCCCN(c1ccc(/C=C(\C#N)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2)cc1)c1ccc(/C=C(\C#N)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2)cc1,CN(C)C=O,446.0
CCCCCCN(c1ccc(/C=C(\C#N)c2ccc(-c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)cc3)cc2)cc1)c1ccc(/C=C(\C#N)c2ccc(-c3ccc(/C=C4/SC(=S)N(CC(=O)O)C4=O)cc3)cc2)cc1,CN(C)C=O,458.0
CCCCCCN(c1ccc(/C=C(\C#N)c2ccc(/C=C(\C#N)C(=O)O)s2)cc1)c1ccc(/C=C(\C#N)c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,CN(C)C=O,458.0
CCCCCCN(c1ccc(/C=C(\C#N)c2ccc(C=C(C(=O)O)C(=O)O)s2)cc1)c1ccc(/C=C(\C#N)c2ccc(C=C(C(=O)O)C(=O)O)s2)cc1,CN(C)C=O,465.0
CCCCCCN(c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1)c1ccc(/C=C(\C#N)c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)s2)cc1,ClC(Cl)Cl,449.0
CCCCCCN(c1ccc(/C=N/Nc2ccc(C(=O)O)cc2)cc1)c1ccc(/C=C(\C#N)c2ccc(/C=N/Nc3ccc(C(=O)O)cc3)s2)cc1,ClC(Cl)Cl,472.0
CCCCCCN(c1ccc(C=C2C(=O)NC(=O)NC2=O)cc1)c1ccc(/C=C(\C#N)c2ccc(C=C3C(=O)NC(=O)NC3=O)s2)cc1,ClC(Cl)Cl,479.0
CCCCCCN(c1ccccc1)c1ccc(/C=C(\C#N)c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)s2)cc1,ClC(Cl)Cl,445.0
CCCCCCN(c1ccccc1)c1ccc(/C=C(\C#N)c2ccc(/C=N/c3ccc(C(=O)O)cc3)s2)cc1,ClC(Cl)Cl,466.0
CCCCCCN(c1ccccc1)c1ccc(/C=C/c2cc(=O)oc3cc(C)ccc23)cc1,CS(C)=O,432.0
CCCCCCN(c1ccccc1)c1ccc(/C=C/c2cc(=O)oc3cc(C)ccc23)cc1,ClC(Cl)Cl,424.0
CCCCCCN(c1ccccc1)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1,CC#N,464.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,C1CCOC1,464.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,C1COCCO1,466.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CC#N,427.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CC(C)=O,465.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CCOC(C)=O,462.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CN(C)C=O,426.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CS(C)=O,430.0
CCCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,ClCCl,479.0
CCCCCCN1/C(=C\C2=C([O-])/C(=C\C3=[N+](C)c4ccc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCC5(CO6)COc6c(/C=C(\C#N)C(=O)O)sc(-c7ccc8c(c7)CC(/C=C7/C(=O)C(/C=C9\N(CCCCCC)c%10ccccc%10C9(C)C)=C7[O-])=[N+]8C)c6OC5)cc4C3)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,661.0
CCCCCCN1/C(=C\C2=C([O-])/C(=C\C3=[N+](C)c4ccc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OC[C@]5(COc7c(/C=C(\C#N)C(=O)O)sc(-c8ccc(N(c9ccc(OC)cc9)c9ccc(OC)cc9)cc8)c7OC5)CO6)cc4C3)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,660.0
CCCCCCN1B2c3c(cccc3-c3cc(-c4ccccc4)ccc3N2CCCCCC)-c2cc(-c3ccccc3)ccc21,ClCCl,342.0
CCCCCCN1B2c3c(cccc3-c3cc(-c4cccs4)ccc3N2CCCCCC)-c2cc(-c3cccs3)ccc21,ClCCl,346.0
CCCCCCN1B2c3c(cccc3-c3ccccc3N2CCCCCC)-c2ccccc21,ClCCl,359.0
CCCCCCN1B2c3c4c(cc(-c5ccccc5)c5cccc1c54)cc1cc(-c4ccccc4)c4cccc(c4c31)N2CCCCCC,ClCCl,454.0
CCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc(C(=O)O)ccc21,ClCCl,643.0
CCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCC)c4ccc(-c5cc6c(OCC(CC)CCCC)c7sc(C=C(C#N)C(=O)O)cc7c(OCC(CC)CCCC)c6s5)cc4C3(C)C)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,664.0
CCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=O)Sc2ccc(OC)cc21,CCO,648.0
CCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=O)Sc2ccccc21,CCO,640.0
CCCCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCCCC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc(C(=O)O)ccc21,ClCCl,646.0
CCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc32)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,ClC(Cl)Cl,400.0
CCCCCCN1C(=O)/C(=C2/C(=O)N(CCCCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc32)c2ccc(Br)cc21,ClC(Cl)Cl,400.0
CCCCCCN1C(=O)C(c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)=C(c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)C1=O,ClC(Cl)Cl,400.0
CCCCCCN1C(=O)C(c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)=C(c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)C1=O,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,412.0
CCCCCCN1C(=O)C(c2ccc(-n3c4ccccc4c4ccccc43)cc2)=C(c2ccc(-n3c4ccccc4c4ccccc43)cc2)C1=O,ClC(Cl)Cl,421.0
CCCCCCN1C(=O)C(c2ccc(-n3c4ccccc4c4ccccc43)cc2)=C(c2ccc(-n3c4ccccc4c4ccccc43)cc2)C1=O,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,426.0
CCCCCCN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)N(CCCCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(C(C)(C)C)cc3)c3ccc(C(C)(C)C)cc3)cc2)cc1,ClCCl,519.0
CCCCCCN1C(=O)C2=C(c3ccc(-c4ccc5c(c4)Sc4ccccc4N5CCCCCC)cc3)N(CCCCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,ClCCl,500.0
CCCCCCN1C(=O)C2=C(c3ccc(-c4ccc5c(c4)Sc4ccccc4N5CCCCCC)cc3)N(CCCCCC)C(=O)C2=C1c1ccc(/C=C(\C#N)C(=O)O)cc1,ClCCl,523.0
CCCCCCN1C(=O)C2=C(c3ccc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc3)N(CCCCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,ClCCl,543.0
CCCCCCN1C(=O)C2=C(c3ccc4c(c3)Sc3ccccc3N4CCCCCC)N(CCCCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,ClCCl,526.0
CCCCCCN1C(=O)c2c(-c3ccc(C=C(C#N)C(=O)O)s3)sc(-c3ccc(-c4cc5c6c(c4)CCCN6CCC5)s3)c2C1=O,C1CCOC1,510.0
CCCCCCN1C(=O)c2c(-c3ccc(C=C(C#N)C(=O)O)s3)sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c2C1=O,C1CCOC1,485.0
CCCCCCN1C(=O)c2cccc3c(-c4cc(F)c(C=O)c(F)c4)ccc(c23)C1=O,CN(C)C=O,349.0
CCCCCCN1C(=O)c2cccc3c(-c4cc(F)cc(F)c4)ccc(c23)C1=O,CN(C)C=O,347.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5cc(-c6ccc(C)cc6)n(-c6ccccc6)n5)s4)ccc(c23)C1=O,ClCCl,402.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5cc(-c6ccc(C)cc6)nn5-c5ccccc5)s4)ccc(c23)C1=O,ClCCl,389.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5cc(-c6ccc(Cl)cc6)n(-c6ccccc6)n5)s4)ccc(c23)C1=O,ClCCl,402.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5cc(-c6ccc(OC)cc6)n(-c6ccccc6)n5)s4)ccc(c23)C1=O,ClCCl,403.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5cc(-c6ccccc6)n(-c6ccccc6)n5)s4)ccc(c23)C1=O,ClCCl,400.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5cc(-c6ccccc6)nn5-c5ccccc5)s4)ccc(c23)C1=O,ClCCl,388.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5ccc(-c6ccc7c8c(cccc68)C(=O)N(CCCCCC)C7=O)s5)s4)ccc(c23)C1=O,ClC(Cl)Cl,428.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5ccc6c7c(cccc57)C(=O)N(CCCCCC)C6=O)s4)ccc(c23)C1=O,ClC(Cl)Cl,395.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(-c5cccs5)s4)ccc(c23)C1=O,ClC(Cl)Cl,409.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(C=O)c(F)c4)ccc(c23)C1=O,CN(C)C=O,348.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(C=O)c(F)c4F)ccc(c23)C1=O,CN(C)C=O,347.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(C=O)cc4F)ccc(c23)C1=O,CN(C)C=O,347.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(Cl)cc4)ccc(c23)C1=O,CN(C)C=O,354.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(Cl)s4)ccc(c23)C1=O,ClC(Cl)Cl,374.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(F)cc4)ccc(c23)C1=O,CN(C)C=O,354.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc(OC)s4)ccc(c23)C1=O,ClC(Cl)Cl,407.0
CCCCCCN1C(=O)c2cccc3c(-c4ccc([N+](=O)[O-])s4)ccc(c23)C1=O,ClC(Cl)Cl,363.0
CCCCCCN1C(=O)c2cccc3c(-c4cccs4)ccc(c23)C1=O,ClC(Cl)Cl,371.0
CCCCCCN1C(=O)c2cccc3c(Oc4ccc(C=O)cc4)ccc(c23)C1=O,CN(C)C=O,356.0
CCCCCCN1C(=O)c2cccc3c(Oc4ccc([N+](=O)[O-])cc4)ccc(c23)C1=O,CN(C)C=O,354.0
CCCCCCN1C(=O)c2cccc3c(Oc4cccc(Br)c4)ccc(c23)C1=O,CN(C)C=O,356.0
CCCCCCN1C(=O)c2cccc3c(Oc4ccccc4)ccc(c23)C1=O,CN(C)C=O,357.0
CCCCCCN1C(=O)c2cccc3cc(/N=C\c4c[nH]c5c4ccc4ccccc45)cc(c23)C1=O,ClC(Cl)Cl,342.0
CCCCCCN1C(=O)c2cccc3cc(/N=C\c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc(c23)C1=O,ClC(Cl)Cl,380.0
CCCCCCN1C(=O)c2cccc3cc(/N=C\c4ccc(N5CCOCC5)cc4)cc(c23)C1=O,ClC(Cl)Cl,322.0
CCCCCCN1C(=O)c2cccc3cc(/N=C\c4cnc5ccccc5c4)cc(c23)C1=O,ClC(Cl)Cl,328.0
CCCCCCN1C(=O)c2cccc3cc(/N=C\c4nc5ccccc5s4)cc(c23)C1=O,ClC(Cl)Cl,370.0
CCCCCCN1C(=O)c2cccc3cccc(c23)C1=O,CN(C)C=O,334.0
CCCCCCN1NC2C(N1)C1C3SC(c4ccc(N(c5ccccc5)c5ccccc5)cc4)CC3N(CC(CC)CCCC)C1C1C2C2SC(/C=C(\C#N)C(=O)O)CC2N1CC(CC)CCCC,ClCCl,548.0
CCCCCCN1NC2C(N1)C1C3SC(c4ccc(N(c5ccccc5)c5ccccc5)cc4)CC3N(CCCCCC)C1C1C2C2SC(/C=C(\C#N)C(=O)O)CC2N1CCCCCC,ClCCl,548.0
CCCCCCN1c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)cc2Sc2cc(-c3ccc(-n4c5ccccc5c5ccccc54)s3)ccc21,ClCCl,467.0
CCCCCCN1c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2Sc2cc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)ccc21,ClCCl,634.0
CCCCCCN1c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2Sc2cc(-c3sc(C=C(C#N)C(=O)O)c4c3OCCO4)ccc21,ClCCl,484.0
CCCCCCN1c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)s3)cc2Sc2cc(-c3sc(C=C(C#N)C(=O)O)c4c3OCCO4)ccc21,ClCCl,495.0
CCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2Sc2cc(-c3ccc(OC)cc3)ccc21,C1CCOC1,406.0
CCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2S(=O)(=O)c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)ccc21,C1CCOC1,416.0
CCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,CN(C)C=O,482.0
CCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2Sc2cc(-c3ccc(OC)cc3OC)ccc21,C1CCOC1,457.0
CCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2Sc2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc21,C1CCOC1,441.0
CCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2Sc2ccc(-c3ccc(OC)cc3)cc21,C1CCOC1,449.0
CCCCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2Sc2ccc(-c3ccc4ccccc4c3)cc21,C1CCOC1,434.0
CCCCCCN1c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2Sc2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)ccc21,ClCCl,470.0
CCCCCCN1c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2Sc2cc(-c3ccc(-c4ccc5c(c4)c4ccccc4n5CCCCCC)s3)ccc21,ClCCl,462.0
CCCCCCN1c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2Sc2cc(-c3ccc(-n4c5ccccc5c5ccccc54)s3)ccc21,ClCCl,481.0
CCCCCCN1c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2Sc2cc(-c3sc(-n4c5ccccc5c5ccccc54)c4c3OCCO4)ccc21,ClCCl,490.0
CCCCCCN1c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,463.0
CCCCCCN1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2CCc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,459.0
CCCCCCN1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2S(=O)(=O)c2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,C1CCOC1,418.0
CCCCCCN1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2Sc2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,C1CCOC1,446.0
CCCCCCN1c2ccc(-c3ccc(OC)cc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,442.0
CCCCCCN1c2ccc(-c3ccc(OC)cc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,471.0
CCCCCCN1c2ccc(-c3ccc(OC[C@@H](CC)CCCC)cc3)cc2Sc2cc(-c3cc4[nH]c5cc([C@H](C#N)C(=O)O)sc5c4s3)ccc21,ClCCl,490.0
CCCCCCN1c2ccc(-c3ccc(OC[C@@H](CC)CCCC)cc3)cc2Sc2cc(-c3ccc(-c4cc5[nH]c6cc([C@H](C#N)C(=O)O)sc6c5s4)c4nc(-c5ccc(OC[C@@H](CC)CCCC)cc5)c(-c5ccc(OC[C@@H](CC)CCCC)cc5)nc34)ccc21,ClCCl,521.0
CCCCCCN1c2ccc(-c3ccc(OC[C@@H](CC)CCCC)cc3)cc2Sc2cc(-c3ccc(-c4cc5[nH]c6cc([C@H](C#N)C(=O)O)sc6c5s4)c4nn(C[C@@H](CC)CCCC)nc34)ccc21,ClCCl,506.0
CCCCCCN1c2ccc(-c3ccc(OC[C@@H](CC)CCCC)cc3)cc2Sc2cc(-c3ccc(-c4cc5[nH]c6cc([C@H](C#N)C(=O)O)sc6c5s4)c4nsnc34)ccc21,ClCCl,543.0
CCCCCCN1c2ccc(-c3ccc(SC)cc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,442.0
CCCCCCN1c2ccc(-c3ccc4[n+](c3)[B-](F)(F)N3C=CC=CC3=C4C#N)cc2Sc2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc21,C1CCOC1,466.0
CCCCCCN1c2ccc(-c3ccc4cc(OC)ccc4c3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,450.0
CCCCCCN1c2ccc(-c3ccc4cc(OCCOCCOCCOC)ccc4c3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,437.0
CCCCCCN1c2ccc(-c3ccc4ccccc4c3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,455.0
CCCCCCN1c2ccc(-c3ccccc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,ClCCl,479.5
CCCCCCN1c2ccc(-c3ccccc3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,466.5
CCCCCCN1c2ccc(-c3sc(C=C(C#N)C(=O)O)c4c3OCCO4)cc2Sc2cc(-c3sc(-n4c5ccccc5c5ccccc54)c4c3OCCO4)ccc21,ClCCl,498.0
CCCCCCN1c2ccc(-c3scc4c3OCCO4)cc2Sc2cc(-c3sc(C=C(C#N)C(=O)O)c4c3OCCO4)ccc21,ClCCl,486.0
CCCCCCN1c2ccc(/C=C(/C#N)C(=O)O)cc2Sc2cc(-c3ccc(-c4ccc5[n+](c4)[B-](F)(F)N4C=CC=CC4=C5C#N)s3)ccc21,C1CCOC1,481.0
CCCCCCN1c2ccc(/C=C(/C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,C1CCOC1,450.0
CCCCCCN1c2ccc(/C=C(/C#N)C(=O)O)cc2Sc2cc(-n3c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)ccc43)ccc21,ClCCl,417.0
CCCCCCN1c2ccc(/C=C(/C#N)C(=O)O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,461.0
CCCCCCN1c2ccc(/C=C(/C#N)c3ccc(/C=C(\C#N)C(=O)O)s3)cc2Oc2cc(/C=C(\C#N)c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,CN(C)C=O,518.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3cc4c(s3)c3sccc3n4CCCCCC)ccc21,ClCCl,488.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(/C=C/c4ccccc4)cc3)ccc21,ClCCl,471.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,474.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(C=C(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)ccc21,ClCCl,462.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(C=C(c4ccc(N5c6ccccc6Sc6ccccc65)cc4)c4ccc(N5c6ccccc6Sc6ccccc65)cc4)cc3)ccc21,ClCCl,466.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,474.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccc(-c5ccc6c(c5)Sc5cc(/C=C(\C#N)C(=O)O)ccc5N6CCCCCC)cc4)c4ccc(-c5ccc6c(c5)Sc5cc(/C=C(\C#N)C(=O)O)ccc5N6CCCCCC)cc4)cc3)ccc21,ClCCl,467.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(-c5ccc6c(c5)Sc5cc(/C=C(\C#N)C(=O)O)ccc5N6CCCCCC)cc4)cc3)ccc21,ClCCl,471.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)ccc21,ClCCl,466.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)ccc21,C1CCOC1,453.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,469.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc(OC)cc3)ccc21,ClCCl,475.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc4c(c3)-c3ccccc3C4(CCCCCC)CCCCCC)ccc21,ClCCl,465.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-c3ccc4c(c3)c3ccccc3n4CCCCCC)ccc21,ClCCl,473.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-n3c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)ccc43)ccc21,ClCCl,417.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,461.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(CC=Cc3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)ccc21,Clc1ccccc1,470.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(CC=Cc3ccc(N(c4ccccc4)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)ccc21,Clc1ccccc1,485.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(N(c3ccc4c(c3)c3ccccc3n4CCCCCC)c3ccc4c(c3)c3ccccc3n4CCCCCC)ccc21,ClCCl,512.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(N(c3ccc4ccsc4c3)c3ccc4c(c3)c3ccccc3n4CCCCCC)ccc21,ClCCl,510.0
CCCCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2ccc(C=C3SC(SC)=C(SC)S3)cc21,CO,432.0
CCCCCCN1c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,476.0
CCCCCCN1c2ccc(/C=C3/SC(=S)C(CC(=O)O)C3=O)cc2Sc2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc21,ClCCl,493.0
CCCCCCN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-c3ccc(C)cc3)ccc21,ClCCl,471.0
CCCCCCN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,482.0
CCCCCCN1c2ccc(/C=C\c3ccc4c(c3)Sc3cc(/C=C(\C#N)C(=O)O)ccc3N4CCCCCC)cc2Sc2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,468.0
CCCCCCN1c2ccc(C#Cc3ccc(-c4ccc(C#Cc5ccc6c(c5)Sc5cc(/C=C(/C#N)C(=O)O)ccc5N6CCCCCC)cc4)cc3)cc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,C1CCOC1,449.0
CCCCCCN1c2ccc(C#Cc3ccc(C#Cc4ccc5c(c4)Sc4cc(/C=C(/C#N)C(=O)O)ccc4N5CCCCCC)cc3)cc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,C1CCOC1,448.0
CCCCCCN1c2ccc(C#Cc3ccc4c5ccc(C#Cc6ccc7c(c6)Sc6cc(/C=C(/C#N)C(=O)O)ccc6N7CCCCCC)cc5n(CCCC)c4c3)cc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,C1CCOC1,413.0
CCCCCCN1c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,CC#N,438.0
CCCCCCN1c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2Sc2cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)ccc21,CC#N,475.0
CCCCCCN1c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2Sc2cc(C=C(C#N)C#N)ccc21,CC#N,471.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,474.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc(C=C(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)ccc21,ClCCl,462.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc(C=C(c4ccc(N5c6ccccc6Sc6ccccc65)cc4)c4ccc(N5c6ccccc6Sc6ccccc65)cc4)cc3)ccc21,ClCCl,466.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,474.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc(C=Cc4ccccc4)cc3)ccc21,ClCCl,471.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc(N(c4ccc5c(c4)C(CCC)(CCC)c4ccccc4-5)c4ccc5c(c4)C(CCC)(CCC)c4ccccc4-5)cc3)ccc21,ClCCl,464.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(-c3ccc4c(c3)c3ccccc3n4CCCCCC)ccc21,ClCCl,470.0
CCCCCCN1c2ccc(C=C(C#N)C(=O)O)cc2Sc2cc(N(c3ccc(C(C)(C)c4ccccc4)cc3)c3ccc(C(C)(C)c4ccccc4)cc3)ccc21,ClCCl,478.0
CCCCCCN1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)ccc43)ccc21,ClCCl,464.0
CCCCCCN1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,482.0
CCCCCCN1c2ccc(C=C3SC(SC)=C(SC)S3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)ccc21,ClCCl,472.0
CCCCCCN1c2ccc(C=C3SC(SC)=C(SC)S3)cc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,448.0
CCCCCCN1c2ccc(C=C3SC(SC)=C(SC)S3)cc2Sc2cc(C=C(C#N)C(=O)O)ccc21,ClCCl,448.0
CCCCCCN1c2ccc(C=CCc3ccc4c(c3)Sc3cc(/C=C(\C#N)C(=O)O)ccc3N4CCCCCC)cc2Sc2cc(CC=Cc3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)ccc21,Clc1ccccc1,474.0
CCCCCCN1c2ccccc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21,C1CCOC1,474.0
CCCCCCN1c2ccccc2Sc2cc(-c3cc(-c4sc(/C=C(\C#N)C(=O)O)cc4-c4ccc5c(c4)Sc4ccccc4N5CCCCCC)sc3-c3ccc4c(c3)Sc3ccccc3N4CCCCCC)ccc21,ClCCl,425.0
CCCCCCN1c2ccccc2Sc2cc(-c3cc4c5nc(-c6ccccc6)c(-c6ccccc6)nc5c5cc(/C=C(\C#N)C(=O)O)sc5c4s3)ccc21,C1CCOC1,474.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)ccc21,ClCCl,490.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)cc7)s6)=C5C(=O)N4CC(CC)CCCC)s3)ccc21,ClCCl,604.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc(C=C(C#N)C(=O)O)s3)ccc21,ClCCl,478.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)Sc3cc(-c5ccc6c(c5)Sc5cc(/C=C(\C#N)C(=O)O)ccc5N6CCCCCC)ccc3N4CCCCCC)ccc21,ClCCl,478.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)Sc3cc(/C=C(\C#N)C(=O)O)ccc3N4CCCCCC)ccc21,ClCCl,477.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)Sc3cc(/C=C5\SC(=S)N(CC(=O)O)C5=O)ccc3N4CCCCCC)ccc21,ClCCl,503.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)c3nc5cc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)ccc5nc3n4CC)ccc21,CN(C)C=O,392.0
CCCCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)c3nc5cc(-c6ccc(/C=C(\C#N)C(=O)O)s6)ccc5nc3n4CC)ccc21,CN(C)C=O,411.0
CCCCCCN1c2ccccc2Sc2cc(-n3cc(/C=C(\C#N)C(=O)O)c4ccccc43)ccc21,CCO,379.0
CCCCCCN1c2ccccc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,C1CCOC1,438.5
CCCCCCN1c2ccccc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,CCO,428.0
CCCCCCN1c2ccccc2Sc2cc(/C=C(/C#N)C(=O)O)ccc21,ClCCl,458.6666666666667
CCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,C1CCOC1,438.0
CCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,CO,420.0
CCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,459.0
CCCCCCN1c2ccccc2Sc2cc(/C=C/c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c(/C=C/c4ccc5c(c4)Sc4ccccc4N5CCCCCC)cc3-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,CCO,382.0
CCCCCCN1c2ccccc2Sc2cc(/C=C3/SC(=S)N(C(=O)O)C3=O)ccc21,C1CCOC1,465.0
CCCCCCN1c2ccccc2Sc2cc(/C=C3\C(=O)c4ccc(C(=O)O)cc4C3=O)ccc21,CN(C)C=O,504.0
CCCCCCN1c2ccccc2Sc2cc(C=Cc3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)ccc21,ClCCl,490.0
CCCCCCN1c2ccccc2Sc2cc(C=Cc3ccc(N(c4ccccc4)c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4)cc3)ccc21,ClCCl,475.0
CCCCCCNC(=O)c1sc(-c2ccc(-c3cc(-c4ccc(C(C)(C)C)cc4)c(C(=O)NCCCCCC)s3)s2)cc1-c1ccc(C(C)(C)C)cc1,ClCCl,392.0
CCCCCCNc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,ClCCl,467.0
CCCCCCOc1c(Cl)c(Oc2ccc(S(=O)(=O)O)cc2)c(OCCCCCC)c2c1C1=N/C2=N\c2c3c(OCCCCCC)c(Cl)c(Oc4ccc(S(=O)(=O)O)cc4)c(OCCCCCC)c3c3n2[Zn]n2/c(c4c(OCCCCCC)c(Cl)c(Oc5ccc(S(=O)(=O)O)cc5)c(OCCCCCC)c4/c2=N/1)=N\C1=N/C(=N\3)c2c(OCCCCCC)c(Cl)c(Oc3ccc(S(=O)(=O)O)cc3)c(OCCCCCC)c21,CS(C)=O,731.0
CCCCCCOc1c(OC)cc(/C2=C3\C=CC(=N3)/C(C#Cc3ccc(/C=C\C(=O)O)s3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc3ccc5cccc6ccc(c2)c3c56)=C2/C=CC(=N2)/C=4c2cc(OC)c(OCCCCCC)c(OC)c2)cc1OC,ClCCl,447.0
CCCCCCOc1c(OC)cc(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3cc5cccc6ccc7cccc3c7c65)=C3/C=CC2=N3)/C(c2cc(OC)c(COCCCCC)c(OC)c2)=C2/C=CC(=N2)/C=4C#Cc2ccc(/C=C(/C#N)C(=O)O)s2)cc1OC,ClCCl,639.0
CCCCCCOc1c(OCCCCCC)c(-c2cc(CCCCCC)c(-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)s2)c2nc3c4ccccc4c4ccccc4c3nc2c1-c1cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s1,ClC(Cl)Cl,513.0
CCCCCCOc1c(OCCCCCC)c(-c2cc(CCCCCC)c(-c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)s2)c2nc3c4ccccc4c4ccccc4c3nc2c1-c1cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s1,ClCCl,513.0
CCCCCCOc1c(OCCCCCC)c(-c2cc(CCCCCC)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c2nc3c4ccccc4c4ccccc4c3nc2c1-c1cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s1,ClC(Cl)Cl,504.0
CCCCCCOc1c(OCCCCCC)c(-c2cc(CCCCCC)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c2nc3c4ccccc4c4ccccc4c3nc2c1-c1cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s1,ClCCl,504.0
CCCCCCOc1c(OCCCCCC)c(-c2ccc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)s2)c2nsnc2c1-c1ccc(/C=C(\C#N)C(=O)O)s1,C1CCOC1,536.0
CCCCCCOc1c(OCCCCCC)c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)o2)c2nc(C)c(C)nc2c1-c1ccc(/C=C(\C#N)C(=O)O)o1,ClC(Cl)Cl,438.0
CCCCCCOc1c(OCCCCCC)c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)o2)c2nc(C)c(C)nc2c1-c1ccc(/C=C(\C#N)C(=O)O)o1,ClCCl,438.0
CCCCCCOc1c(OCCCCCC)c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c2nc(C)c(C)nc2c1-c1ccc(/C=C(\C#N)C(=O)O)s1,ClC(Cl)Cl,477.0
CCCCCCOc1c(OCCCCCC)c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c2nc(C)c(C)nc2c1-c1ccc(/C=C(\C#N)C(=O)O)s1,ClCCl,477.0
CCCCCCOc1c(OCCCCCC)c(-c2ccc(/C=C(\C#N)C(=O)O)s2)c2nsnc2c1-c1ccc2c(c1)C(CC)(CC)c1cc(N(c3ccccc3)c3ccccc3)ccc1-2,C1CCOC1,454.0
CCCCCCOc1c(OCCCCCC)c(-c2ccc(/C=C(\C#N)C(=O)O)s2)c2nsnc2c1C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,478.0
CCCCCCOc1c(OCCCCCC)c2cc(-c3cc4c(s3)-c3sc(/C=C(\C#N)C(=O)O)cc3C4(CCCCCC)CCCCCC)sc2c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc12,C1CCOC1,497.0
CCCCCCOc1c(OCCCCCC)c2cc(-c3cc4c5nn([C@@H](CC)CCCCC)nc5c5cc(/C=C(/C#N)C(=O)O)sc5c4s3)sc2c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc12,C1CCOC1,470.0
CCCCCCOc1c(OCCCCCC)c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)sc2c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc12,C1CCOC1,456.0
CCCCCCOc1c(OCCCCCC)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc2c2sc(/C=C(\C#N)C(=O)O)cc12,C1CCOC1,435.0
CCCCCCOc1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)sc2c(OCCCCCC)c2cc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)sc12,C1CCOC1,477.0
CCCCCCOc1c2cc(-c3ccc4c(c3)[C@H]3CCC[C@H]3N4c3ccc(C)cc3)sc2c(OCCCCCC)c2cc(-c3ccc(C=C(C#N)C(=O)O)cc3)sc12,ClCCl,460.0
CCCCCCOc1c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)cc2c(OCCCCCC)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc12,C1CCOC1,500.0
CCCCCCOc1c2ccc(N(c3ccccc3)c3ccc4c(c3)Sc3ccccc3N4CCCCCC)cc2c(OCCCCCC)c2ccc(/C=C(\C#N)C(=O)O)cc12,C1CCOC1,494.0
CCCCCCOc1c2ccc(N(c3ccccc3)c3ccc4cc5ccccc5cc4c3)cc2c(OCCCCCC)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc12,C1CCOC1,493.0
CCCCCCOc1c2ccc(N(c3ccccc3)c3ccccc3)cc2c(OCCCCCC)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc12,C1CCOC1,479.0
CCCCCCOc1c2ccccc2c(OCCCCCC)c2cc(N(c3ccccc3)c3ccc4c(c3)Sc3cc(/C=C(\C#N)C(=O)O)ccc3N4CCCCCC)ccc12,C1CCOC1,440.0
CCCCCCOc1cc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c(OCCCCCC)cc1C1=CC=C(/C=C(\C#N)C(=O)O)C1,ClCCl,478.0
CCCCCCOc1cc(-c2ccc(-n3c(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc3/C=C(\C#N)C(=O)O)cc2)c(OCCCCCC)cc1-c1ccc(-n2c(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2/C=C(\C#N)C(=O)O)cc1,ClCCl,426.0
CCCCCCOc1cc(-c2ccc3c(c2)N(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2S3)ccc1C=C1SC(SCCCCCC)=C(SCCCCCC)S1,C1CCOC1,387.0
CCCCCCOc1cc(-n2cc(-c3ccc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)nn2)c(OCCCCCC)cc1C=C(C#N)C(=O)O,ClCCl,406.0
CCCCCCOc1cc(-n2cc(-c3ccc(N(c4ccc(-c5cn(-c6cc(OCCCCCC)c(/C=C(/C#N)C(=O)O)cc6OCCCCCC)nn5)cc4)c4ccc(-c5cn(-c6cc(OCCCCCC)c(/C=C(/C#N)C(=O)O)cc6OCCCCCC)nn5)cc4)cc3)nn2)c(OCCCCCC)cc1/C=C(/C#N)C(=O)O,C1COCCO1,348.0
CCCCCCOc1cc(-n2cc(-c3ccc(N(c4ccccc4)c4ccc(-c5cn(-c6cc(OCCCCCC)c(/C=C(/C#N)C(=O)O)cc6OCCCCCC)nn5)cc4)cc3)nn2)c(OCCCCCC)cc1/C=C(/C#N)C(=O)O,C1COCCO1,405.0
CCCCCCOc1cc(-n2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nn2)c(OCCCCCC)cc1/C=C(/C#N)C(=O)O,C1COCCO1,388.0
CCCCCCOc1cc(-n2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nn2)c(OCCCCCC)cc1C=C(C#N)C(=O)O,C1COCCO1,388.0
CCCCCCOc1cc(/C=C/c2cc(OCCCCCC)c(/C=C/c3cc(OCCCCCC)c(C=C(C#N)C#N)cc3OCCCCCC)cc2OCCCCCC)c(OCCCCCC)cc1C=C(C#N)C#N,ClCCl,518.0
CCCCCCOc1cc(/C=C/c2cc(OCCCCCC)c(/C=C/c3cc(OCCCCCC)c(C=C4C(=C(C#N)C#N)c5ccccc5C4=C(C#N)C#N)cc3OCCCCCC)cc2OCCCCCC)c(OCCCCCC)cc1C=C1C(=C(C#N)C#N)c2ccccc2C1=C(C#N)C#N,ClCCl,640.0
CCCCCCOc1cc(/C=C/c2cc(OCCCCCC)c(/C=C/c3cc(OCCCCCC)c(C=C4C(=O)c5ccccc5C4=O)cc3OCCCCCC)cc2OCCCCCC)c(OCCCCCC)cc1C=C1C(=O)c2ccccc2C1=O,ClCCl,550.0
CCCCCCOc1cc(/C=C/c2cc(OCCCCCC)c(/C=C/c3cc(OCCCCCC)c(C=O)cc3OCCCCCC)cc2OCCCCCC)c(OCCCCCC)cc1C=O,ClCCl,449.0
CCCCCCOc1cc(/C=C/c2cc3ccc2CCc2ccc(c(/C=C/c4cc(OCCCCCC)c(/C=C(\C#N)C(=O)O)cc4OCCCCCC)c2)CC3)c(OCCCCCC)cc1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,419.0
CCCCCCOc1cc(/C=C/c2cc3ccc2CCc2ccc(c(/C=C/c4cc(OCCCCCC)c(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4OCCCCCC)c2)CC3)c(OCCCCCC)cc1C=C(C#N)C(=O)O,C1CCOC1,419.0
CCCCCCOc1cc(/C=C/c2ccc(N(c3ccc(/C=C/c4cc(OCCCCCC)cc(OCCCCCC)c4)cc3)c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)cc(OCCCCCC)c1,ClCCl,444.0
CCCCCCOc1cc(/C=C2\C(=O)c3ccccc3C2=C(C#N)C#N)c(OCCCCCC)cc1/C=C1\C(=O)c2ccccc2C1=C(C#N)C#N,ClCCl,548.0
CCCCCCOc1cc(C=C(C#N)C#N)c(OCCCCCC)cc1C=C(C#N)C#N,ClCCl,477.0
CCCCCCOc1cc(C=C2C(=C(C#N)C#N)c3ccccc3C2=C(C#N)C#N)c(OCCCCCC)cc1C=C1C(=C(C#N)C#N)c2ccccc2C1=C(C#N)C#N,ClCCl,542.0
CCCCCCOc1cc(C=C2C(=O)c3ccccc3C2=O)c(OCCCCCC)cc1C=C1C(=O)c2ccccc2C1=O,ClCCl,512.0
CCCCCCOc1cc(C=C2c3ccccc3-c3ccccc32)c(OCCCCCC)cc1C=C1c2ccccc2C=Cc2ccccc21,C1CCOC1,397.0
CCCCCCOc1cc(C=O)c(OCCCCCC)cc1C=O,ClCCl,403.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c(c2)c2ccccc2n3CC)s1,ClCCl,570.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,C1CCOC1,584.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,C1COCCO1,542.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CC#N,550.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CC(C)=O,552.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CCO,546.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CCOC(C)=O,544.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CN(C)C=O,550.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CS(C)=O,572.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C(\C#N)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,ClCCl,560.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/C(=C(C#N)C#N)c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,512.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/C(=C(C#N)C#N)c1ccc2c(c1)c1ccccc1n2CC,ClCCl,504.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,C1CCOC1,554.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,C1COCCO1,552.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CC#N,556.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CC(C)=O,558.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CCO,556.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CCOC(C)=O,544.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CN(C)C=O,554.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CS(C)=O,564.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C/c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,ClCCl,566.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,C1CCOC1,483.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,C1COCCO1,476.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,CC#N,487.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,CC(C)=O,486.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,CCO,486.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,CCOC(C)=O,479.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,CN(C)C=O,485.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,CS(C)=O,501.0
CCCCCCOc1cc(N(CC)CC)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,ClCCl,492.0
CCCCCCOc1cc(OCCCCCC)c2c(c1)C(C)(C)c1cc(N(c3ccc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5C(CCCCCC)CCCCCC)cc3)c3ccc4c(c3)C(C)(C)c3cc(OCCCCCC)cc(OCCCCCC)c3-4)ccc1-2,ClCCl,541.0
CCCCCCOc1cc(OCCCCCC)c2c(c1)C(C)(C)c1ccc(N(c3ccc(-c4cc5c(s4)-c4sc(/C=C(\C#N)C(=O)O)cc4C5(CCCCCC)CCCCCC)cc3)c3ccc4c(c3)C(C)(C)c3cc(OCCCCCC)cc(OCCCCCC)c3-4)cc1-2,ClCCl,554.0
CCCCCCOc1cc(OCCCCCC)c2c(c1)C(C)(C)c1ccc(N(c3ccc(-c4cc5c(s4)-c4sc(C=C(C#N)C(=O)O)cc4C5(CCCCCC)CCCCCC)cc3)c3ccc4c(c3)C(C)(C)c3cc(OCCCCCC)cc(OCCCCCC)c3-4)cc1-2,ClCCl,554.0
CCCCCCOc1cc(OCCCCCC)cc(-n2c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)sc3c3sc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5-c4ccc(OCCCCCC)cc4OCCCCCC)cc32)c1,ClCCl,536.0
CCCCCCOc1cc2c(cc1N(c1ccc(-c3cc4c(s3)c3sccc3n4-c3ccccc3OCCCCCC)cc1)c1ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccccc3OCCCCCC)cc1)c1ccccc1n2CCCCCC,ClCCl,518.0
CCCCCCOc1cc2c3c4c1cccc4c1cccc4c(-c5ccc(C6=C7C(=O)N(CC(CC)CCCC)C(c8ccc(-c9ccc(/C=C(/C#N)C(=O)O)s9)cc8)=C7C(=O)N6CC(CC)CCCC)cc5)cc(c3c41)n2CC(CC)CCCC,ClC(Cl)Cl,527.0
CCCCCCOc1cc2c3c4c1cccc4c1cccc4c(-c5ccc(C6=C7C(=O)N(C[C@@H](CC)CCCC)C(c8ccc(-c9ccc(/C=C(\C#N)C(=O)O)s9)cc8)=C7C(=O)N6C[C@H](CC)CCCC)cc5)cc(c3c41)n2C[C@@H](CC)CCCC,ClC(Cl)Cl,527.0
CCCCCCOc1cc2cc(=O)oc3ccc4cccc1c4c23,CC1CCCO1,460.0
CCCCCCOc1ccc(-c2c3c4cc(-c5ccc(C#Cc6ccc(C(=O)O)cc6)c6nsnc56)ccc4n(CCCCCC)c3c(-c3ccc(OCCCCCC)c(OCCCCCC)c3)c3c4ccccc4n(CCCCCC)c23)cc1OCCCCCC,ClCCl,492.0
CCCCCCOc1ccc(-c2c3ccc(-c4ccc(-c5ccc(-c6ccc(N(c7ccc(OCCCCCC)cc7)c7ccc(OCCCCCC)cc7)cc6)s5)s4)cc3c(-c3ccc(OCCCCCC)cc3)c3ccc(C=C(C#N)C(=O)O)cc23)cc1,ClCCl,499.0
CCCCCCOc1ccc(-c2c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)cc3c(-c3ccc(OCCCCCC)cc3)c3ccc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)cc23)cc1,ClCCl,490.0
CCCCCCOc1ccc(-c2c3ccc(-c4ccc(-c5ccc(N(c6ccc(OCCCCCC)cc6)c6ccc(OCCCCCC)cc6)cc5)s4)cc3c(-c3ccc(OCCCCCC)cc3)c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc23)cc1,ClCCl,499.0
CCCCCCOc1ccc(-c2c3ccc(-c4ccc(-c5ccc(N(c6ccc(OCCCCCC)cc6)c6ccc(OCCCCCC)cc6)cc5)s4)cc3c(-c3ccc(OCCCCCC)cc3)c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc23)cc1,ClCCl,499.0
CCCCCCOc1ccc(-c2cc3c(s2)N(CCCCCC)c2ccc(/C=C(\C#N)C(=O)O)cc2S3)cc1,ClCCl,543.0
CCCCCCOc1ccc(-c2cc3c(s2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3CCCCCC)cc1,ClCCl,518.0
CCCCCCOc1ccc(-c2cc3cc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nc(-c6ccc(OCC(CC)CCCCC)cc6)c(-c6ccc(OCC(CC)CCCCC)cc6)nc45)cc4c3n2-c2ccccc2S4)cc1,ClCCl,424.0
CCCCCCOc1ccc(-c2cc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc4c3n2-c2ccccc2S4)cc1,ClCCl,400.0
CCCCCCOc1ccc(-c2ccc(-c3c(CC(CC)CCCC)c4cc(-c5ccc(OCCCCCC)cc5OCCCCCC)ccn4c3-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c(OCCCCCC)c1,ClCCl,607.5
CCCCCCOc1ccc(-c2ccc(-c3c(CC(CC)CCCC)c4cc(-c5ccc(OCCCCCC)cc5OCCCCCC)ccn4c3-c3ccc(/C=c4\s/c(=C5\SC(=S)N(CCCCCC)C5=O)n(CC(=O)O)c4=O)s3)cc2)c(OCCCCCC)c1,ClCCl,605.0
CCCCCCOc1ccc(-c2ccc(-c3c(CC(CC)CCCC)c4cc(-c5ccc(OCCCCCC)cc5OCCCCCC)ccn4c3/C=c3\s/c(=C4\SC(=S)N(CCCCCC)C4=O)n(CC(=O)O)c3=O)cc2)c(OCCCCCC)c1,ClCCl,597.0
CCCCCCOc1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccc(OCCCCCC)cc6)s5)cc4)c4ccc(-c5sc(/C=C6/SC(=S)N(CC(=O)O)C6=O)c6c5OCCO6)cc4)cc3)s2)cc1,ClC(Cl)Cl,537.0
CCCCCCOc1ccc(-c2ccc(C(=Cc3ccc(N4c5ccc(-c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)s7)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,534.0
CCCCCCOc1ccc(-c2ccc(C(=Cc3ccc(N4c5ccc(-c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)s7)c7nc(-c8ccccc8)c(-c8ccccc8)nc67)cc5[C@@H]5CCC[C@@H]54)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,534.0
CCCCCCOc1ccc(-c2ccc(C(=Cc3ccc(N4c5ccc(-c6ccc(C7=C8C(=O)N(CC(CC)CCCC)C(c9ccc(-c%10ccc(C(=O)O)cc%10)cc9)=C8C(=O)N7CC(CC)CCCC)s6)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,583.0
CCCCCCOc1ccc(-c2ccc(C(=Cc3ccc(N4c5ccc(-c6ccc(C7=C8C(=O)N(CC(CC)CCCC)C(c9ccc(-c%10ccc(C=C(C#N)C(=O)O)cc%10)cc9)=C8C(=O)N7CC(CC)CCCC)s6)cc5C5CCCC54)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,590.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc(COCCC[C@H](C)[C@@H]5CC[C@@H]6[C@H]7[C@@H](O)CC8C[C@@H](O)CC[C@@]8(C)[C@@H]7CC[C@@]56C)c(-c5ccc(/C=C(\C#N)C(=O)O)o5)s4)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,489.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)-c4sc(C=C(C#N)C(=O)O)cc4C5(CCCCCC)CCCCCC)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,542.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5C(CCCCCC)CCCCCC)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,526.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5c(s4)c4sc(C=C(C#N)C(=O)O)cc4n5C(CCCCCC)CCCCCC)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,526.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4cc5sc(/C=C(/C#N)C(=O)O)cc5s4)cc3)c3ccc(-c4cc5sc(/C=C(\C#N)C(=O)O)cc5s4)cc3)cc2)c(OCCCCCC)c1,CCO,477.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,CCO,450.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)cc2)cc1,ClCCl,505.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4)cc3)c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)cc3)cc2)cc1,CC#N,455.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)c3ccc(-c4sc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)c5c4OCCO5)cc3)cc2)c(OCCCCCC)c1,ClCCl,533.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)cc3)cc2)c(OCCCCCC)c1,ClCCl,518.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)c3ccc4c(c3)C(C)(C)c3sc(-c5ccc(C=C(C#N)C(=O)O)s5)cc3-4)cc2)c(OCCCCCC)c1,CCO,474.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)c3ccc4c(c3)sc3cc(-c5cc6sc(C=C(C#N)C(=O)O)cc6s5)sc34)cc2)c(OCCCCCC)c1,C1CCOC1,467.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)c3ccc4c(c3)sc3cc(-c5ccc(C=C(C#N)C(=O)O)s5)sc34)cc2)c(OCCCCCC)c1,C1CCOC1,469.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)c3ccc4c(c3)sc3cc(C5(C=C(C#N)C(=O)O)CC=C(c6cccs6)S5)sc34)cc2)c(OCCCCCC)c1,C1CCOC1,475.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)c3ccc4c5sc(-c6ccc(-c7ccc(C=C(C#N)C(=O)O)cc7)c7nsnc67)cc5n(CCCCCC)c4c3)cc2)c(OCCCCCC)c1,C1CCOC1,543.0
CCCCCCOc1ccc(-c2ccc(N(c3ccc(/C=c4\s/c(=C(\C#N)C(=O)O)nc4-c4ccccc4)cc3)c3ccc(-c4ccc(OCCCCCC)cc4OCCCCCC)cc3)cc2)c(OCCCCCC)c1,ClCCl,628.0
CCCCCCOc1ccc(-c2ccc(N3c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)cc4C4CCCC43)cc2)c(OCCCCCC)c1,ClCCl,522.0
CCCCCCOc1ccc(-c2ccc(N3c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)c6nc(-c7ccccc7)c(-c7ccccc7)nc56)cc4[C@@H]4CCC[C@@H]43)cc2)c(OCCCCCC)c1,ClCCl,522.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(-c4sc(-c5cc[n+](C(=O)O)cc5)cc4CCCCCC)ccc2N3CCCCCC)c(OCCCCCC)c1,ClCCl,520.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3CC)cc1,ClCCl,464.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3CCCCCC)cc1,ClCCl,474.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3c2ccc(OCCCCCC)cc2)cc1,C1CCOC1,470.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3c2ccc(OCCOCCOCCOC)cc2)cc1,C1CCOC1,468.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)sc2N3CCCCCC)cc1,ClCCl,554.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C/C4=[N+](CCCCCC)c5ccc(C(=O)O)cc5C4(C)C)ccc2N3CCCCCC)c(OCCCCCC)c1,ClCCl,679.0
CCCCCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C/c4cc[n+](CC(=O)O)cc4)ccc2N3CCCCCC)c(OCCCCCC)c1,ClCCl,508.0
CCCCCCOc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OCCCCCC)cc4)ccc2n3-c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)cc2)cc1,CCO,427.0
CCCCCCOc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OCCCCCC)cc4)ccc2n3-c2ccc3c(c2)C(C)(C)c2cc(-c4ccc(C=C(C#N)C(=O)O)s4)sc2-3)cc1,CCO,438.0
CCCCCCOc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OCCCCCC)cc4OCCCCCC)ccc2n3-c2ccc3c(c2)C(C)(C)c2cc(-c4ccc(C=C(C#N)C(=O)O)s4)sc2-3)c(OCCCCCC)c1,CCO,441.0
CCCCCCOc1ccc(-c2cnc(-c3nnc(-c4ccc(OCCCCCC)cc4)o3)o2)cc1,C1CCCCC1,316.0
CCCCCCOc1ccc(-c2cnc(-c3nnc(-c4ccc(OCCCCCC)cc4)o3)o2)cc1,C1CCOC1,319.0
CCCCCCOc1ccc(-c2cnc(-c3nnc(-c4ccc(OCCCCCC)cc4)o3)o2)cc1,CC#N,320.0
CCCCCCOc1ccc(-c2cnc(-c3nnc(-c4ccc(OCCCCCC)cc4)o3)o2)cc1,CCO,322.0
CCCCCCOc1ccc(-c2cnc(-c3nnc(-c4ccc(OCCCCCC)cc4)o3)o2)cc1,CO,320.0
CCCCCCOc1ccc(-c2cnc(-c3nnc(-c4ccc(OCCCCCC)cc4)o3)o2)cc1,ClC(Cl)Cl,325.0
CCCCCCOc1ccc(-c2nc3c(-c4cc(CCCCCC)c(C=C(C#N)C(=O)O)s4)ccc(-c4ccc(-c5ccc(N(c6ccc(OCCCCCC)cc6)c6ccc(OCCCCCC)cc6)cc5)s4)c3n2C)cc1,Cc1ccccc1,456.0
CCCCCCOc1ccc(-c2nc3c(-c4ccc(C=C(C#N)C(=O)O)s4)ccc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c3nc2-c2ccc(OCCCCCC)c(OCCCCCC)c2)cc1OCCCCCC,C1CCOC1,513.0
CCCCCCOc1ccc(-c2nc3c4cc(-c5ccc(N(c6ccc(OC)cc6)c6ccc(OC)cc6)cc5)sc4c4sc(-c5ccc(/C=C(\C#N)C(=O)O)o5)cc4c3nc2-c2ccc(OCCCCCC)cc2)cc1,C1CCOC1,487.0
CCCCCCOc1ccc(-c2nc3c4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)sc4c4sc(-c5ccc(/C=C(\C#N)C(=O)O)o5)cc4c3nc2-c2ccc(OCCCCCC)cc2)cc1,C1CCOC1,475.0
CCCCCCOc1ccc(-c2nc3c4cc(/C=C(\C#N)C(=O)O)sc4c4sc(-c5ccc6c(c5)Sc5ccccc5N6CCCCCC)cc4c3nc2-c2ccc(OCCCCCC)cc2)cc1,C1CCOC1,462.0
CCCCCCOc1ccc(-n2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(C5=C6C(C)=CC(C)=[N+]6[B-](F)(F)n6c(C)cc(C)c65)cc4)cc32)c(OCCCCCC)c1,ClCCl,502.0
CCCCCCOc1ccc(-n2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccc6c(c5)sc5ccsc56)c5ccc6c(c5)sc5ccsc56)cc4)cc32)c(OCCCCCC)c1,ClCCl,511.0
CCCCCCOc1ccc(-n2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccc6ccsc6c5)c5ccc6ccsc6c5)cc4)cc32)c(OCCCCCC)c1,ClCCl,523.0
CCCCCCOc1ccc(-n2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc32)c(OCCCCCC)c1,ClCCl,493.0
CCCCCCOc1ccc(-n2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc5c(c4)Sc4ccccc4N5CCCCCC)cc32)c(OCCCCCC)c1,ClCCl,513.0
CCCCCCOc1ccc(-n2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(C4=C5C(C)=CC(C)=[N+]5[B-](F)(F)n5c(C)cc(C)c54)cc32)c(OCCCCCC)c1,ClCCl,519.0
CCCCCCOc1ccc(-n2c3cc(C=C(C#N)C(=O)O)sc3c3sc(-c4ccc(-c5ccc6c(c5)C5CCCC5N6c5ccc(C)cc5)c5nonc45)cc32)cc1,ClCCl,558.0
CCCCCCOc1ccc(-n2c3cc(C=C(C#N)C(=O)O)sc3c3sc(-c4ccc(-c5ccc6c(c5)C5CCCC5N6c5ccc(C)cc5)c5nsnc45)cc32)cc1,ClCCl,563.0
CCCCCCOc1ccc(-n2c3cc(C=C(C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc32)cc1,ClC(Cl)Cl,476.0
CCCCCCOc1ccc(-n2c3cc(C=C(C#N)C(=O)O)sc3c3sc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)cc32)cc1,ClCCl,549.0
CCCCCCOc1ccc(-n2c3cc(C=C(C#N)C(=O)O)sc3c3sc(-c4sc(-c5ccc6c(c5)C5CCCC5N6c5ccc(C)cc5)c5c4OCCO5)cc32)cc1,ClCCl,570.0
CCCCCCOc1ccc(-n2c3ccsc3c3sc(-c4ccc5c(c4)Sc4cc(/C=C(\C#N)C(=O)O)ccc4N5CCCCCC)cc32)cc1,ClCCl,473.0
CCCCCCOc1ccc(-n2c3ccsc3c3sc(/C=C(\C#N)C(=O)O)cc32)c(OCCCCCC)c1,ClCCl,460.0
CCCCCCOc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,565.0
CCCCCCOc1ccc(/C=C/c2ccc(N(c3ccc(/C=C/c4ccc(OCCCCCC)cc4)cc3)c3ccc(-c4nc5ccccc5nc4-c4ccc(N(c5ccc(/C=C/c6ccc(OCCCCCC)cc6)cc5)c5ccc(/C=C/c6ccc(OCCCCCC)cc6)cc5)cc4)cc3)cc2)cc1,C1CCOC1,378.0
CCCCCCOc1ccc(/C=C/c2ccc(N(c3ccc(/C=C/c4ccc(OCCCCCC)cc4)cc3)c3ccc(-c4nc5ccccc5nc4-c4ccc(N(c5ccc(/C=C/c6ccc(OCCCCCC)cc6)cc5)c5ccc(/C=C/c6ccc(OCCCCCC)cc6)cc5)cc4)cc3)cc2)cc1,Cc1ccccc1,374.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,C1CCCCC1,507.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,CCOC(C)=O,496.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,CN(C)C=O,500.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,COc1ccccc1,502.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,Cc1ccccc1,500.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,ClC(Cl)Cl,504.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,ClCCCl,501.0
CCCCCCOc1ccc(C#Cc2ccc(-c3ccc(-c4ccc(C#Cc5ccc(OCCCCCC)c(OCCCCCC)c5)s4)c4nsnc34)s2)cc1OCCCCCC,ClCCl,500.0
CCCCCCOc1ccc(C#Cc2ccc(C#CC#Cc3ccc(C#Cc4ccc(OCCCCCC)c(OCCCCCC)c4)c4nsnc34)c3nsnc23)cc1OCCCCCC,CN(C)C=O,468.0
CCCCCCOc1ccc(C#Cc2ccc(C#CC#Cc3ccc(C#Cc4ccc(OCCCCCC)c(OCCCCCC)c4)c4nsnc34)c3nsnc23)cc1OCCCCCC,COc1ccccc1,472.0
CCCCCCOc1ccc(C#Cc2ccc(C#CC#Cc3ccc(C#Cc4ccc(OCCCCCC)c(OCCCCCC)c4)c4nsnc34)c3nsnc23)cc1OCCCCCC,Cc1ccccc1,470.0
CCCCCCOc1ccc(C#Cc2ccc(C#CC#Cc3ccc(C#Cc4ccc(OCCCCCC)c(OCCCCCC)c4)c4nsnc34)c3nsnc23)cc1OCCCCCC,ClC(Cl)Cl,472.0
CCCCCCOc1ccc(C#Cc2ccc(C#CC#Cc3ccc(C#Cc4ccc(OCCCCCC)c(OCCCCCC)c4)c4nsnc34)c3nsnc23)cc1OCCCCCC,ClCCCl,471.0
CCCCCCOc1ccc(C#Cc2ccc(C#CC#Cc3ccc(C#Cc4ccc(OCCCCCC)c(OCCCCCC)c4)c4nsnc34)c3nsnc23)cc1OCCCCCC,ClCCl,469.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,C1CCCCC1,446.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,CCOC(C)=O,440.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,CN(C)C=O,443.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,COc1ccccc1,448.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,Cc1ccccc1,448.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,ClC(Cl)Cl,447.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,ClCCCl,444.0
CCCCCCOc1ccc(C#Cc2ccc(C#Cc3ccc(OCCCCCC)c(OCCCCCC)c3)c3nsnc23)cc1OCCCCCC,ClCCl,445.0
CCCCCCOc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,429.0
CCCCCCOc1ccc(C(c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)cc2)c2ccc3c(c2)c2cc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)s5)cc4)ccc2n3CCCCCC)cc1,C1CCOC1,497.0
CCCCCCOc1ccc(C2(c3ccc(OCCCCCC)cc3)c3cc4c(cc3-c3sc(/C=C(\C#N)C(=O)O)cc32)C(c2ccc(OCCCCCC)cc2)(c2ccc(OCCCCCC)cc2)c2cc(N(c3ccc(C)cc3)c3cccc(C)c3)sc2-4)cc1,C1CCOC1,500.0
CCCCCCOc1ccc(C2(c3ccc(OCCCCCC)cc3)c3cc4c(cc3-c3sc(/C=C(\C#N)C(=O)O)cc32)C(c2ccc(OCCCCCC)cc2)(c2ccc(OCCCCCC)cc2)c2cc(N(c3ccc(OC)cc3)c3cccc(OC)c3)sc2-4)cc1,C1CCOC1,520.0
CCCCCCOc1ccc(C2(c3ccc(OCCCCCC)cc3)c3cc4c(cc3-c3sc(/C=C(\C#N)C(=O)O)cc32)C(c2ccc(OCCCCCC)cc2)(c2ccc(OCCCCCC)cc2)c2cc(N(c3ccccc3)c3ccccc3)sc2-4)cc1,C1CCOC1,490.0
CCCCCCOc1ccc(C2=c3c(c4ccc(OC)cc4c4c(OC)cc(OC)cc34)=[N+]3C2=Nc2c(-c4ccc(OCCCCCC)cc4)c4c5cc(OC)cc(OC)c5c5cc(OC)ccc5c4n2[B-]3(F)F)cc1,Cc1ccccc1,804.0
CCCCCCOc1ccc(C2=c3c(c4ccc(OC)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=Nc2c(-c4ccc(OCCCCCC)cc4)c4c5ccc(C(C)(C)C)cc5c5cc(OC)ccc5c4n2[B-]3(F)F)cc1,Cc1ccccc1,790.0
CCCCCCOc1ccc(C2CC(c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)=NN2c2ccc(-c3nc4ccc(C)cc4s3)cc2)cc1,C1CCOC1,505.0
CCCCCCOc1ccc(N(c2ccc(-c3cc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(-c6ccc(-c7ccc(/C=C(/C#N)C(=O)O)s7)s6)cc5)cc4)cc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)c3)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)cc2)cc1,C1CCOC1,440.0
CCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(OCCCCCC)cc3OCCCCCC)cc2)c2ccc3c(c2)sc2ccsc23)cc1,ClCCl,531.0
CCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccccc3OCCCCCC)cc2)c2cc3c4ccccc4n(CCCCCC)c3cc2OCCCCCC)cc1,ClCCl,535.0
CCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)c3scc(C=C(C#N)C(=O)O)c3n4-c3ccc(OCCCCCC)cc3)cc2)c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2c4c(c5c(c2-3)C(CCCCCC)(CCCCCC)c2ccccc2-5)C(CCCCCC)(CCCCCC)c2ccccc2-4)cc1,ClCCl,534.0
CCCCCCOc1ccc(N(c2ccc(-c3cc4c(s3)c3scc(C=C(C#N)C(=O)O)c3n4CCCCCC)cc2)c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2c4c(c5c(c2-3)C(CCCCCC)(CCCCCC)c2ccccc2-5)C(CCCCCC)(CCCCCC)c2ccccc2-4)cc1,ClCCl,532.0
CCCCCCOc1ccc(N(c2ccc(-c3ccc(-c4cc5c(s4)C(CCCCCC)(CCCCCC)c4cc(/C=C(\C#N)C(=O)O)sc4-5)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)c2ccc(OCCCCCC)cc2OCCCCCC)c(OCCCCCC)c1,ClCCl,542.0
CCCCCCOc1ccc(N(c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)cc2)c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2cc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)s5)cc4)ccc2-3)cc1,C1CCOC1,494.0
CCCCCCOc1ccc(N(c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)c2ccc(N(c3ccc(OCCCCCC)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)cc2)cc1,C1CCOC1,458.0
CCCCCCOc1ccc(N(c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2cc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)ccc2-3)cc1,C1CCOC1,494.0
CCCCCCOc1ccc(N(c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)c2ccc3c(c2)Sc2cc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)ccc2N3CCCCCC)cc1,C1CCOC1,490.0
CCCCCCOc1ccc(N(c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)c2ccc3c(c2)c2cc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)ccc2n3CCCCCC)cc1,C1CCOC1,497.0
CCCCCCOc1ccc(N(c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)c2cccc(N(c3ccc(OCCCCCC)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)c2)cc1,C1CCOC1,458.0
CCCCCCOc1ccc(N(c2ccc(/C=C/C3C/C(=C(\C#N)C(=O)O)CC(C)(C)C3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,504.0
CCCCCCOc1ccc(N(c2ccc(/C=C/[C@@H]3C/C(=C(\C#N)C(=O)O)CC(C)(C)C3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,504.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3cc(OCCC)c(/C=C(\C#N)C(=O)O)cc3OCCC)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,472.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(N4c5ccccc5Sc5ccccc54)cc3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,510.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc4c(c3)C(CCC)(CCC)c3c5c(c6c(c3-4)C(CCC)(CCC)c3ccccc3-6)C(CCC)(CCC)c3ccccc3-5)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,515.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3cc4c(s3)c3sc(C=C(C#N)C(=O)O)cc3n4-c3ccc(N4c5ccccc5Sc5ccccc54)cc3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,510.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3cc4c(s3)c3sc(C=C(C#N)C(=O)O)cc3n4-c3ccc4c(c3)C(CCC)(CCC)c3c5c(c6c(c3-4)C(CCC)(CCC)c3ccccc3-6)C(CCC)(CCC)c3ccccc3-5)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,515.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,453.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\CC#N)C(=O)O)s3)cc2)c2ccc(OCCCCCC)cc2)cc1,CCO,530.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\CC#N)C(=O)O)s3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,530.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\CC#N)C(=O)S)s3)cc2)c2ccc(OCCCCCC)cc2)cc1,CCO,556.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\CC#N)C(=O)S)s3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,556.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,450.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,490.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)cc4)cc3)cc2)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2)cc1,C1CCOC1,439.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4)cc3)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)cc2)cc1,C1CCOC1,460.0
CCCCCCOc1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4)cc3)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,C1CCOC1,482.0
CCCCCCOc1ccc(N(c2ccc(C#Cc3c4ccccc4c(C#CC#Cc4ccc(C(=O)O)cc4)c4ccccc34)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,511.0
CCCCCCOc1ccc(N(c2ccc(C#Cc3ccc(C#Cc4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,420.0
CCCCCCOc1ccc(N(c2ccc(C#Cc3ccc(C#Cc4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)c2ccc(OCCCCCC)cc2)cc1,ClCCl,403.0
CCCCCCOc1ccc(N(c2ccc(C3SC4C(SC5C6SC7C(CCCCCC)C(/C=C(\C#N)C(=O)O)SC7C6N(c6ccc(OCCCCCC)cc6)C45)C3CCCCCC)cc2)c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2c4c(c5c(c2-3)C(CCCCCC)(CCCCCC)c2ccccc2-5)C(CCCCCC)(CCCCCC)c2ccccc2-4)cc1,ClCCl,538.0
CCCCCCOc1ccc(N(c2ccc(C=C3C(=O)c4cc(C(=O)O)c(C(=O)O)cc4C3=O)cc2)c2ccc(OCCCCCC)cc2)cc1,C1CCOC1,505.0
CCCCCCOc1ccc(N(c2ccc(C=CC(=C(C#N)C(=O)O)c3cc(OCCC)ccc3OCCC)cc2)c2ccc(OCCCCCC)cc2)cc1,CCO,306.0
CCCCCCOc1ccc(N(c2ccc(C=CC(=C(C#N)C(=O)O)c3cc(OCCCCCC)ccc3OCCCCCC)cc2)c2ccc(OCCCCCC)cc2)cc1,CCO,306.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2cc(N(c3ccc(OCCCCCC)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)cc(N(c3ccc(OCCCCCC)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)c2)cc1,C1CCOC1,440.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2cc(OCCCCCC)c(C#Cc3c(CCCCCC)cc(-c4ccc(C(=O)O)cc4)c4nsnc34)cc2OCCCCCC)cc1,CCO,468.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2cc(OCCCCCC)c(C#Cc3c(CCCCCC)cc(C#Cc4c(C)cc(C(=O)O)cc4C)c4nsnc34)cc2OCCCCCC)cc1,CCO,492.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2cc(OCCCCCC)c(C#Cc3c(CCCCCC)cc(C#Cc4ccc(C(=O)O)cc4C)c4nsnc34)cc2OCCCCCC)cc1,CCO,492.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2cc3c(s2)-c2ccc(-c4ncc(/C=C(\C#N)C(=O)O)cn4)cc2C3(c2ccc(C)cc2)c2ccc(C)cc2)cc1,C1CCOC1,528.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2cc3c4cc(-c5cc6c(s5)c5sc(C=C(C#N)C(=O)O)cc5n6-c5cccc(OCCCCCC)c5)ccc4n(CCCCCC)c3cc2OCCCCCC)cc1,ClCCl,517.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(/C=C(\C#N)C(=O)O)cc4)c4nn(CCCCCC)nc34)cc2)cc1,C1CCOC1,454.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(/C=C(\C#N)C(=O)O)cc4)c4nsnc34)cc2)cc1,C1CCOC1,532.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(/C=C(\C#N)C(=O)O)s4)c4nn(CCCCCC)nc34)cc2)cc1,C1CCOC1,464.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(/C=C(\C#N)C(=O)O)s4)c4nsnc34)cc2)cc1,C1CCOC1,544.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(C=C(C#N)C(=O)O)cc4)c4nn(CCCCCC)nc34)cc2)cc1,C1CCOC1,454.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(C=C(C#N)C(=O)O)cc4)c4nsnc34)cc2)cc1,C1CCOC1,532.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(C=C(C#N)C(=O)O)s4)c4nn(CCCCCC)nc34)cc2)cc1,C1CCOC1,464.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(C=C(C#N)C(=O)O)s4)c4nsnc34)cc2)cc1,C1CCOC1,544.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(C#CC#Cc4ccc(C(=O)O)cc4)c4ccccc34)cc2)cc1,ClCCl,448.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3c4ccccc4c(C#CC#Cc4ccc(C=C(C#N)C(=O)O)cc4)c4ccccc34)cc2)cc1,ClCCl,461.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc(-c4cc(-c5ccc(N(c6ccc(OCCCCCC)cc6)c6ccc(OCCCCCC)cc6)cc5)sc4-c4ccc(/C=C(\C#N)C(=O)O)s4)c(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,ClCCl,483.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc(CCCCCC)c(-c4cc5c(s4)c4sc(-c6cc(CCCCCC)c(/C=C(/C#N)C(=O)O)s6)cc4n5-c4ccc(OCCCCCC)cc4)s3)cc2)cc1,ClCCl,512.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc(CCCCCC)c(-c4cc5c(s4)c4sc6c(CCCCCC)c(/C=C(\C#N)C(=O)O)sc6c4n5-c4ccc(OCCCCCC)cc4)s3)cc2)cc1,ClCCl,510.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc(CCCCCC)c(C4CC5C(S4)C4SC6C(CCCCCC)C(/C=C(\C#N)C(=O)O)SC6C4N5c4ccc(OCCCCCC)cc4)s3)cc2)cc1,ClCCl,510.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5cc(C(=O)O)cc(-c6cc(C(=O)O)cc(-c7cc8c(s7)-c7sc(-c9ccc(N(c%10ccc(OCCCCCC)cc%10)c%10ccc(OCCCCCC)cc%10)cc9)cc7C8(CCCCCC)CCCCCC)n6)n5)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,471.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccc(C(=O)O)c(-c6ccc(C(=O)O)c(-c7cc8c(s7)-c7sc(-c9ccc(N(c%10ccc(OCCCCCC)cc%10)c%10ccc(OCCCCCC)cc%10)cc9)cc7C8(CCCCCC)CCCCCC)n6)n5)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,478.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccc6cc(/C=C(/C#N)C(=O)O)c(=O)[nH]c6c5)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,469.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccc6cc(/C=C(/C#N)C(=O)O)c(Cl)nc6c5)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,477.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccc6cc(C(=O)O)c(=O)[nH]c6c5)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,504.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccc6cc(C(=O)O)c(Cl)nc6c5)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,473.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccc6cc(C=C(C#N)C#N)c(=O)[nH]c6c5)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,470.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,C1CCOC1,443.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,C1COCCO1,443.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,CC#N,437.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,CC(C)=O,439.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,CCCCCC,439.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,CCO,445.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,CCOC(C)=O,442.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,CN(C)C=O,444.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,CS(C)=O,448.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,Cc1ccccc1,443.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5ccncc5)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,ClCCl,443.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5cnc(-c6ccc(-c7ccncc7)cc6)c6nsnc56)cc3[Ge]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,C1CCOC1,572.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(-c5cnc(-c6ccc(-c7ccncc7)s6)c6nsnc56)cc3[Ge]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,C1CCOC1,604.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(/C=C(\C#N)C(=O)O)cc3C4(CCCCCC)CCCCCC)c3nsnc23)cc1,ClCCl,498.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(/C=C(\C#N)C(=O)O)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,545.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(/C=C(\C#N)C(=O)O)cc3[Ge]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,C1CCOC1,492.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(/C=C(\C#N)C(=O)O)cc3[Si]4(CC(CC)CCCC)CC(CC)CCCC)cc2)cc1,C1CCOC1,496.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(C=C(C#N)C(=O)O)cc3C4(CC)CC)cc2)cc1,Clc1ccccc1,548.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(C=C(C#N)C(=O)O)cc3C4(CCCCCC)CCCCCC)cc2)cc1,ClCCl,549.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc(C=C(C#N)C(=O)O)cc3C4(F)F)cc2)cc1,Clc1ccccc1,555.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)-c3sc5c6c(sc5c3C4(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)-c3sc(C=C(C#N)C(=O)O)cc3C6(c3ccc(CCCCCC)cc3)c3ccc(CCCCCC)cc3)cc2)cc1,C1CCOC1,565.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)C(C)=C(c3sc(/C=C(/C#N)C(=O)O)c5c3OCCO5)S4(=O)=O)cc2)cc1,ClC(Cl)Cl,492.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c(OCCCCCC)c(OCCCCCC)c3sc(/C=C(\C#N)C(=O)O)cc34)cc2)cc1,ClC(Cl)Cl,459.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c(OCCCCCC)c(OCCCCCC)c3sc(/C=C(\C#N)C(=O)O)cc34)s2)cc1,ClC(Cl)Cl,502.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3c5nsnc5c5c6sc(C#Cc7ccc(-c8ccc(C(=O)O)cc8)c8nsnc78)cc6n(CC(CC)CCCC)c5c3n4CC(CC)CCCC)cc2)cc1,ClCCl,523.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4-c3ccc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)cc3)cc2)cc1,ClCCl,533.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc(C=C(C#N)C(=O)O)cc3n4-c3ccc(OCCCCCC)cc3)c3nsnc23)cc1,ClCCl,567.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc(C=C(C#N)C(=O)O)cc3n4CCCCCC)c3nsnc23)cc1,ClCCl,571.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc5c(CCCCCC)c(/C=C(\C#N)C(=O)O)sc5c3n4-c3ccc(OCCCCCC)cc3)cc2)cc1,ClCCl,508.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc5c6sc(/C=C(\C#N)C(=O)O)cc6n(-c6ccc(OCCCCCC)cc6)c5c3n4-c3ccc(OCCCCCC)cc3)cc2)cc1,ClCCl,560.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc5c6sc(/C=C(\C#N)C(=O)O)cc6n(CCCCCC)c5c3n4CCCCCC)cc2)cc1,ClCCl,562.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc5c6sc(C=C(C#N)C(=O)O)cc6n(-c6ccc(CCCCCC)cc6)c5c3n4-c3ccc(CCCCCC)cc3)cc2)cc1,ClCCl,560.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc5c6sc(C=C(C#N)C(=O)O)cc6n(-c6ccc(OCCCCCC)cc6)c5c3n4-c3ccc(OCCCCCC)cc3)cc2)cc1,ClCCl,560.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3sc5c6sc(C=C(C#N)C(=O)O)cc6n(CCCCCC)c5c3n4CCCCCC)cc2)cc1,ClCCl,562.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4c(s3)c3scc(C=C(C#N)C(=O)O)c3n4CCCCCC)cc2)cc1,ClCCl,524.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4sc(-c5cc6sc(C=C(C#N)C(=O)O)cc6s5)cc4s3)cc2)cc1,ClC(Cl)Cl,524.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4sc(-c5sc(/C=C(/C#N)C(=O)O)c6c5OCCO6)c(C)c4s3)cc2)cc1,ClC(Cl)Cl,494.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3cc4sc5cc(-c6sc(/C=C(/C#N)C(=O)O)c7c6OCCO7)sc5c4s3)cc2)cc1,ClC(Cl)Cl,497.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc(-c5ccc(-c6cc(-c7ccc(C=C(C#N)C(=O)O)s7)sc6-c6ccc(-c7ccc(N(c8ccc(OCCCCCC)cc8)c8ccc(OCCCCCC)cc8)cc7)s6)s5)c(-c5ccc(C=C(C#N)C(=O)O)s5)s4)s3)cc2)cc1,ClC(Cl)Cl,480.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc(-c5ccc(/C=C(/C#N)C(=O)O)cc5)c(-c5ccc(C=C(C#N)C(=O)O)cc5)s4)s3)cc2)cc1,C1CCOC1,462.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc(CCCCCC)c(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)c4nsnc34)cc2)cc1,ClCCl,553.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc5c(s4)-c4sc(C=C(C#N)C(=O)O)cc4C5(CCCCCC)CCCCCC)c4nsnc34)cc2)cc1,ClCCl,556.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc5c(s4)/C(=C(\C#N)C(=O)O)c4ccccc4-5)s3)cc2)cc1,C1CCOC1,536.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc5c(s4)/C(=C/c4ccc(/C=C(\C#N)C(=O)O)s4)c4ccccc4-5)s3)cc2)cc1,C1CCOC1,546.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5CCCCCC)cc3)cc2)cc1,ClCCl,484.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc5c6nc(CCCCC)c(CCCCC)nc6c6cc(/C=C(\C#N)C(=O)O)sc6c5s4)c4nsnc34)cc2)cc1,ClC(Cl)Cl,529.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4cc5sc(/C=C(\C#N)C(=O)O)cc5s4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CN(C)C=O,481.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5c(C)cc(/C(C#N)=C/C(=O)O)cc5C)c5nsnc45)s3)cc2)cc1,ClCCl,482.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5c(C)cc(/C=C/C(=O)O)cc5C)c5nsnc45)s3)cc2)cc1,ClCCl,480.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s5)c5nsnc45)s3)cc2)cc1,ClCCl,569.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5cc(CCCCCC)c(/C=C/C(=O)O)s5)c5nsnc45)s3)cc2)cc1,ClCCl,539.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)c6nsnc56)s4)s3)cc2)cc1,ClCCl,515.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(N(c7ccc(OCCCCCC)cc7)c7ccc(OCCCCCC)cc7)cc6)s5)c5nc(-c6ccc(/C=C(/C#N)C(=O)O)s6)c(-c6ccc(/C=C(/C#N)C(=O)O)s6)nc45)s3)cc2)cc1,Cc1ccccc1,528.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(N(c7ccc(OCCCCCC)cc7)c7ccc(OCCCCCC)cc7)cc6)s5)c5nc(-c6ccc(/C=C(\C#N)C(=O)O)s6)c(-c6cccs6)nc45)s3)cc2)cc1,Cc1ccccc1,542.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)c6nsnc56)s4)s3)cc2)cc1,ClCCl,570.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc2)cc1,ClC(Cl)Cl,495.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C(=O)O)s5)c5nsnc45)s3)cc2)cc1,ClCCl,527.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C(C#N)=CC(=O)O)cc5)c5nsnc45)s3)cc2)cc1,ClCCl,517.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)n5C)c5nsnc45)s3)cc2)cc1,ClCCl,516.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)n5CCCCCC)c5nsnc45)s3)cc2)cc1,ClCCl,516.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nc(-c6ccc(OCCCCCC)c(OCCCCCC)c6)c(-c6ccc(OCCCCCC)c(OCCCCCC)c6)nc45)s3)cc2)cc1,C1CCOC1,532.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nc(CCC)n(C)c45)s3)cc2)cc1,Cc1ccccc1,439.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)s3)cc2)cc1,ClCCl,560.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(C=CC(=O)O)cc5)c5nsnc45)s3)cc2)cc1,ClCCl,502.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(CC(=O)O)cc5)c5nsnc45)s3)cc2)cc1,ClCCl,487.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5sc(C=C(C#N)C(=O)O)cc5-c5ccc(CCCCC)cc5)c5nsnc45)s3)cc2)cc1,ClCCl,530.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5sc(C=C(C#N)C(=O)O)cc5C5CCCCC5)c5nsnc45)s3)cc2)cc1,ClCCl,516.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5sc(C=C(C#N)C(=O)O)cc5CCCCCC)c5nsnc45)s3)cc2)cc1,ClCCl,522.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)c(-c3cc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)ccc3-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)c2)cc1,ClCCl,503.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)cc2)cc1,ClCCl,516.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CN(C)C=O,477.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)c(-c3cc(N(c4ccc(OCCCCCC)cc4)c4ccc(OCCCCCC)cc4)ccc3-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)c2)cc1,ClCCl,503.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,C1CCOC1,486.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,CCO,458.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,CN(C)C=O,520.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,ClCCl,516.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)c5ccc(-c6ccc(C(=O)O)cc6)cc5)s4)c4nsnc34)cc2)cc1,ClCCl,518.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)c5ccc(-c6ccc(C(=O)O)cc6)s5)s4)c4nsnc34)cc2)cc1,ClCCl,529.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)c5ccc(C(=O)O)cc5)s4)c4nsnc34)cc2)cc1,ClCCl,522.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(C5=C([O-])/C(=C\C6C=[N+](CCCC)c7ccc(C(=O)O)cc76)C5=O)s4)s3)cc2)cc1,CCO,650.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(C5=C([O-])C(=CC6=[N+](CCCC)c7ccc(C(=O)O)cc7C6(C)C)C5=O)s4)s3)cc2)cc1,CCO,640.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)[se]4)[se]3)cc2)cc1,C1CCOC1,520.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)[se]4)[se]3)cc2)cc1,ClC(Cl)Cl,549.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)o4)o3)cc2)cc1,C1CCOC1,486.5
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)o4)o3)cc2)cc1,ClC(Cl)Cl,522.5
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccc(C(=O)O)cc5)c(-c5ccc(C(=O)O)cc5)nc34)cc2)cc1,ClCCl,479.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(C(=O)O)c(C(=O)O)nc34)cc2)cc1,ClCCl,531.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc5c6ccc(C(=O)O)nc6c6nc(C(=O)O)ccc6c5nc34)cc2)cc1,ClCCl,588.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4nc(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)cc5)c(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)cc5)n4CCCCCC)s3)cc2)cc1,ClCCl,512.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4nc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)cc5)c(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)cc5)n4CCCCCC)s3)cc2)cc1,C1CCOC1,400.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4nc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)c(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)n4CCCCCC)s3)cc2)cc1,C1CCOC1,484.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4nc5c(-c6ccc(/C=C(\C#N)C(=O)O)s6)ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)c5n4CCCCCC)s3)cc2)cc1,C1CCOC1,417.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4nc5c(-c6ccc(C=C(C#N)C(=O)O)s6)ccc(-c6ccc(C=C(C#N)C(=O)O)s6)c5n4CCCCCC)s3)cc2)cc1,C1CCOC1,417.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4nc5c6cc(-c7ccc(/C=C(\C#N)C(=O)O)s7)sc6c6sc(-c7ccc(/C=C(\C#N)C(=O)O)s7)cc6c5n4CCCCCC)s3)cc2)cc1,C1CCOC1,460.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ncc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)s5)c5nsnc45)s3)cc2)cc1,ClCCl,591.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ncc(-c5ccc(C=C(C#N)C(=O)O)s5)c5c4nc(CCC)n5C)s3)cc2)cc1,Cc1ccccc1,416.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ncc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nc(CCC)n(C)c45)s3)cc2)cc1,Cc1ccccc1,437.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4ncc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)s3)cc2)cc1,C1CCOC1,580.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5c4OCCO5)c4nsnc34)cc2)cc1,ClCCl,526.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nc(-c6ccc(OCCCCCC)c(OCCCCCC)c6)c(-c6ccc(OCCCCCC)c(OCCCCCC)c6)nc45)s3)cc2)cc1,C1CCOC1,642.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nccnc45)s3)cc2)cc1,ClC(Cl)Cl,525.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)s3)cc2)cc1,CN(C)C=O,528.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C(C#N)=C/c4ccc(/C=C(\C#N)C(=O)O)n4CCCCCC)s3)cc2)cc1,ClCCl,534.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C(C#N)=C/c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,ClCCl,564.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)cc1,C1CCOC1,405.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cn3)cc2)cc1,C1CCOC1,426.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1,C1CCOC1,443.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)n4CCCCCC)s3)cc2)cc1,ClCCl,512.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,ClCCl,518.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C#Cc4ccc(C(=O)O)cc4)c4nsnc34)cc2)cc1,ClCCl,489.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6ccc(-c7ccc(C=C(C#N)C(=O)O)cc7)cc6)=C5C(=O)N4CC(CC)CCCC)s3)cc2)cc1,C1CCOC1,560.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6ccc(-c7ccc(C=C(C#N)C(=O)O)o7)cc6)=C5C(=O)N4CC(CC)CCCC)s3)cc2)cc1,C1CCOC1,587.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)[se]3)cc2)cc1,C1CCOC1,495.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)[se]3)cc2)cc1,ClC(Cl)Cl,525.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)c4nsnc34)s2)cc1,ClCCl,654.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)o3)cc2)cc1,C1CCOC1,469.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)o3)cc2)cc1,ClC(Cl)Cl,506.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,C1CCOC1,482.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,ClC(Cl)Cl,514.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,ClCCl,503.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(C=Cc4cc(CCCCCC)c(C=C(C#N)C(=O)O)s4)o3)cc2)cc1,ClCCl,516.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc(N(c4ccc(-c5ccc(N(c6ccc(OCCCCCC)cc6)c6ccc(OCCCCCC)cc6)cc5)cc4)c4ccc(-c5sc(C=C(C#N)C(=O)O)c6c5OCCO6)cc4)cc3)cc2)cc1,ClCCl,488.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c(=O)n5c6ccc(C(=O)O)cc6nc5c5cccc3c45)cc2)cc1,C1CCOC1,441.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c(=O)n5c6ccc(C(=O)O)cc6nc5c5cccc3c45)cc2)cc1,Cc1ccccc1,443.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c(c3)N(CC(CC)CCCC)C(=O)/C4=C3/C(=O)N(CC(CC)CCCC)c4cc(-c5ccc(/C=C(/C#N)C(=O)O)s5)ccc43)cc2)cc1,ClC(Cl)Cl,450.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5cc6sc(/C=C(\C#N)C(=O)O)cc6s5)ccc3N4CCCCCC)cc2)cc1,C1CCOC1,424.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5ccc(/C=C(/C#N)C(=O)O)s5)ccc3N4CCCCCC)cc2)cc1,C1CCOC1,416.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c(c3)S(=O)(=O)c3cc(-c5csc6cc([C@H](C#N)C(=O)O)sc56)ccc3N4CCCCCC)cc2)cc1,C1CCOC1,424.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c5sc6c7sc(/C=C(\C#N)C(=O)O)cc7n(CCCCCC)c6c5n(CCCCCC)c4c3)cc2)cc1,ClCCl,519.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ccc4c5sc6c7sc(C=C(C#N)C(=O)O)cc7n(CCCCCC)c6c5n(CCCCCC)c4c3)cc2)cc1,ClCCl,519.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3nc4c(-c5cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s5)ccc(-c5cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s5)c4n3CCCCCC)cc2)cc1,C1CCOC1,451.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3nc4c(-c5ccc(-c6cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s6)s5)ccc(-c5ccc(-c6cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s6)s5)c4n3CCCCCC)cc2)cc1,C1CCOC1,488.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ncc(-c4ccc(C=C(C#N)C(=O)O)cc4)c4nsnc34)cc2)cc1,C1CCOC1,525.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ncc(-c4sc(-c5cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s5)cc4CCCCCC)c4nsnc34)cc2)cc1,ClCCl,548.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3ncc(-c4sc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)cc4CCCCCC)c4nsnc34)cc2)cc1,ClCCl,540.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4cc(OCCCCC)c(/C=C(\C#N)C(=O)O)s4)cc3CCCCCC)cc2)cc1,ClC(Cl)Cl,495.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4cc5c6nc(CCCCC)c(CCCCC)nc6c6cc(/C=C(\C#N)C(=O)O)sc6c5s4)c4c3OCCO4)cc2)cc1,ClC(Cl)Cl,553.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4cc5sc(-c6ccc(C(=O)O)c(C#N)c6)cc5s4)c4c3OCCO4)cc2)cc1,CN(C)C=O,437.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4cc5sc(C=C(C#N)C(=O)O)cc5s4)c4c3OCCO4)cc2)cc1,ClC(Cl)Cl,552.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4cc[n+](CC(=O)O)cc4)cc3CCCCCC)cc2)cc1,ClCCl,486.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(-c5cc(CCCCCC)c(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)c5nsnc45)cc3CCCCCC)cc2)cc1,ClCCl,545.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccc(C(=O)OC)cc5)c(-c5ccc(C(=O)OC)cc5)nc34)cc2)cc1,ClCCl,626.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)nc34)cc2)cc1,ClCCl,590.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,C1CCOC1,601.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CC(C)=O,592.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CCOC(C)=O,594.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CCOCC,600.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CN(C)C=O,598.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,Cc1ccccc1,600.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,ClC(Cl)Cl,601.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,ClCCl,600.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(C(=O)O)c(C(=O)O)nc34)cc2)cc1,ClCCl,667.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(C(=O)OCC)c(C(=O)OCC)nc34)cc2)cc1,ClCCl,665.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc(N(c5ccc(OCCCCCC)cc5)c5ccc(OCCCCCC)cc5)cc4)c4nc(CC)c(CC)nc34)cc2)cc1,ClCCl,532.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc5c(-c6ccc(C(C)(C)C)cc6)c6cc(-c7cc(OCCCCC)c(/C=C(/C#N)C(=O)O)s7)ccc6c(-c6ccc(C(C)(C)C)cc6)c5c4)cc3CCCCCC)cc2)cc1,ClC(Cl)Cl,494.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc5c(-c6ccc(C(C)(C)C)cc6)c6cc(-c7cc(OCCCCC)c(/C=C(\C#N)C(=O)O)s7)ccc6c(-c6ccc(C(C)(C)C)cc6)c5c4)cc3CCCCCC)cc2)cc1,ClC(Cl)Cl,494.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc5c(c4)C(=C(c4ccc(C(F)(F)F)cc4)c4ccc(C(F)(F)F)cc4)c4cc(-c6cc(CCCCCC)c(C=C(C#N)C(=O)O)s6)ccc4-5)cc3CCCCCC)cc2)cc1,ClCCl,452.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc5c(c4)C(=C(c4ccc(C)cc4)c4ccc(C)cc4)c4cc(-c6cc(CCCCCC)c(C=C(C#N)C(=O)O)s6)ccc4-5)cc3CCCCCC)cc2)cc1,ClCCl,465.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc5c(c4)C(=C(c4ccc(SC)cc4)c4ccc(SC)cc4)c4cc(-c6cc(CCCCCC)c(C=C(C#N)C(=O)O)s6)ccc4-5)cc3CCCCCC)cc2)cc1,ClCCl,459.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(-c4ccc5c6sc7c8sc(C=C(C#N)C(=O)O)cc8n(CCCCCC)c7c6n(CCCCCC)c5c4)cc3CCCCCC)cc2)cc1,ClCCl,525.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(C4=C([O-])/C(=C\C5=[N+](CCCC)c6ccc(C(=O)O)cc6C5(C)C)C4=O)c4c3OCCO4)cc2)cc1,CCO,691.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(C4=C([O-])/C(=C\c5ccc6cc(/C=C/C(=O)O)ccc6[n+]5C)C4=O)c4c3OCCO4)cc2)cc1,CCO,686.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(C4=C([O-])/C(=C\c5ccc6cc(C(=O)O)ccc6[n+]5C)C4=O)c4c3OCCO4)cc2)cc1,CCO,673.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(C4=C([O-])C(=CC5=[N+](CCCC)c6ccc(C(=O)O)cc6C5(C)C)C4=O)c4c3OCCO4)cc2)cc1,CCO,700.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc(C=C(C#N)C(=O)O)c4c3OCCO4)c3nsnc23)cc1,ClCCl,566.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc4c(sc5c6sc(-c7sc(C=C(C#N)C(=O)O)cc7CCCCCC)cc6n(-c6ccc(OCCCCCC)cc6)c45)c3CCCCCC)cc2)cc1,ClCCl,511.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-c3sc4c(sc5c6sc(/C=C(\C#N)C(=O)O)cc6n(-c6ccc(OCCCCCC)cc6)c45)c3CCCCCC)cc2)cc1,ClCCl,484.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-n3c4cc(/C=C(\C#N)C(=O)O)sc4c4sc(-c5ccc6c(c5)C5CCCC5N6c5ccc6c(c5)C(CCC)(CCC)c5c7c(c8c(c5-6)C(CCC)(CCC)c5ccccc5-8)C(CCC)(CCC)c5ccccc5-7)cc43)cc2)cc1,ClCCl,553.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(-n3c4cc(/C=C(\C#N)C(=O)O)sc4c4sc(-c5ccc6c(c5)C5CCCC5N6c5ccc6c(c5)C(CCC)(CCC)c5ccccc5-6)cc43)cc2)cc1,ClCCl,544.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C34CSC(c5ccc(C=C(C#N)C(=O)O)c6nsnc56)=C3OCCO4)cc2)cc1,Clc1ccccc1,563.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C3=C4C(=O)N(CCCCCC)C(c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)cc5)=C4C(=O)N3CCCCCC)cc2)cc1,ClCCl,538.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C3=C4C(=O)N(C[C@@H](CC)CCCC)C(c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)=C4C(=O)N3C[C@H](CC)CCCC)cc2)cc1,C1CCOC1,640.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C3=C4C(=O)N(C[C@H](CC)CCCC)C(c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)=C4C(=O)N3C[C@H](CC)CCCC)s2)cc1,C1CCOC1,660.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C3C4C(=O)N(CC(CC)CCCC)C(c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)cc5)=C4C(=O)N3CC(CC)CCCC)cc2)cc1,ClCCl,542.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C3CC4C(S3)C3SC5C(CCCCCC)C(/C=C(\C#N)C(=O)O)SC5C3N4c3ccc(OCCCCCC)cc3)cc2)cc1,ClCCl,508.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C3SC4C(SC5C6SC(/C=C(\C#N)C(=O)O)CC6N(c6ccc(OCCCCCC)cc6)C45)C3CCCCCC)cc2)cc1,ClCCl,484.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc(C3SC4C(SC5C6SC7C(CCCCCC)C(/C=C(\C#N)C(=O)O)SC7C6N(c6ccc(OCCCCCC)cc6)C45)C3CCCCCC)cc2)cc1,ClCCl,504.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc([C@@]34CSC(c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)cc6)c6nsnc56)=C3OCCO4)cc2)cc1,Clc1ccccc1,511.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ccc([C@@]34CSC(c5ccc(/C=C(\C#N)C(=O)O)c6nsnc56)=C3OCCO4)cc2)cc1,Clc1ccccc1,563.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ncc(-c3cc4c(s3)-c3sc(/C=C(\C#N)C(=O)O)cc3C4(CCCCCC)CCCCCC)s2)cc1,ClC(Cl)Cl,539.0
CCCCCCOc1ccc(N(c2ccc(OCCCCCC)cc2)c2ncc(-c3cc4c(s3)c(OCCCCCC)c(OCCCCCC)c3sc(/C=C(\C#N)C(=O)O)cc34)s2)cc1,ClC(Cl)Cl,458.0
CCCCCCOc1ccc(N(c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3CCCCCC)c2ccc3c(c2)c2ccccc2n3CCCCCC)cc1,ClCCl,506.0
CCCCCCOc1ccc(N2C3C4SC(/C=C(\C#N)C(=O)O)C(CCCCCC)C4SC3C3SC4C(CCCCCC)C(c5ccc(N(c6ccccc6)c6ccccc6)cc5)SC4C32)cc1,ClCCl,498.0
CCCCCCOc1ccc(N2C3C4SC(c5ccc(N(c6ccccc6)c6ccccc6)cc5)C(CCCCCC)C4SC3C3SC4C(CCCCCC)C(c5ccc(/C=C(/C#N)C(=O)O)c6nsnc56)SC4C32)cc1,ClCCl,491.0
CCCCCCOc1ccc(N2c3ccc(-c4cc5sc(/C=C(\C#N)C(=O)O)c(CCC)c5s4)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,495.0
CCCCCCOc1ccc(N2c3ccc(/C=C(\C#N)C(=O)O)cc3Sc3cc(-c4cc5c(s4)-c4sccc4-c4c6cccc4OCCCCCCCCOc4cccc(c4-5)OCCCCCCCCO6)ccc32)cc1,ClCCl,506.0
CCCCCCOc1ccc(N2c3ccc(/C=C(\C#N)C(=O)O)cc3Sc3cc(-c4ccc(-c5cccs5)s4)ccc32)cc1,ClCCl,493.0
CCCCCCOc1ccc(N2c3ccc(/C=C(\C#N)C(=O)O)cc3Sc3cc(-c4ccc(CCOCOCOCCOC)cc4)ccc32)cc1,C1CCOC1,467.0
CCCCCCOc1ccc(N2c3ccc(/C=C(\C#N)C(=O)O)cc3Sc3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc32)cc1,ClCCl,478.0
CCCCCCOc1ccc(N2c3ccccc3Oc3cc(/C=C(\C#N)C(=O)O)ccc32)cc1,ClCCl,486.0
CCCCCCOc1ccc(N2c3ccccc3Sc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc(-c6ccc7c(c6)C(CCCCCC)(CCCCCC)c6cc(N(c8ccccc8)c8ccccc8)ccc6-7)c(-c6ccc7c(c6)C(CCCCCC)(CCCCCC)c6cc(N(c8ccccc8)c8ccccc8)ccc6-7)nc45)ccc32)cc1,ClCCl,470.0
CCCCCCOc1ccc(N2c3ccccc3Sc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)ccc32)cc1,ClCCl,484.0
CCCCCCOc1ccc(N2c3ccccc3Sc3cc(-c4ccc5c(c4)Sc4cc(-c6ccc7c(c6)Sc6cc(/C=C(\C#N)C(=O)O)ccc6N7c6ccc(OCCCCCC)cc6)ccc4N5c4ccc(OCCCCCC)cc4)ccc32)cc1,ClCCl,496.0
CCCCCCOc1ccc(N2c3ccccc3Sc3cc(-c4ccc5c(c4)Sc4cc(/C=C(\C#N)C(=O)O)ccc4N5c4ccc(OCCCCCC)cc4)ccc32)cc1,ClCCl,495.0
CCCCCCOc1ccc(N2c3ccccc3Sc3cc(/C=C(\C#N)C(=O)O)ccc32)cc1,ClCCl,475.0
CCCCCCOc1ccc(N2c3ccccc3Sc3cc(/C=C/C4C/C(=C(\C#N)C(=O)O)CC(C)(C)C4)ccc32)cc1,ClCCl,491.0
CCCCCCOc1ccc(N2c3ccccc3Sc3cc(/C=C/[C@@H]4C/C(=C(\C#N)C(=O)O)CC(C)(C)C4)ccc32)cc1,ClCCl,491.0
CCCCCCOc1ccc2c(c1)-c1cc3c(cc1[Si]2(C)C)-c1ccccc1[Si]3(C)C,ClCCl,327.0
CCCCCCOc1ccc2c(c1)C(C)(C)c1cc(N(c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)c3ccc4c(c3)C(C)(C)c3cc(OCCCCCC)ccc3-4)ccc1-2,CCO,462.0
CCCCCCOc1ccc2c(c1)C(C)(C)c1cc(N(c3ccc4c(c3)C(C)(C)c3cc(OCCCCCC)ccc3-4)c3ccc4c(c3)C(C)(C)c3c-4sc4cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)sc34)ccc1-2,CCO,493.0
CCCCCCOc1ccc2c(c1)C(C)(C)c1cc(N(c3ccc4c(c3)C(C)(C)c3cc(OCCCCCC)ccc3-4)c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)sc3-4)ccc1-2,CCO,491.0
CCCCCCOc1ccc2c(c1)C1(c3cc(OCCCCCC)ccc3-2)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc5c(c4)N(c4ccc(C)cc4)C4CCCC54)c4nsnc34)cc21,ClCCl,564.0
CCCCCCOc1ccc2c(c1)C1=[N+]3C2=Cc2c4ccc(OCCCCCC)cc4c4n2[B-]3(Oc2ccccc21)Oc1ccccc1-4,C1CCOC1,748.0
CCCCCCOc1ccc2c(c1)Oc1cc(/C=C(\C#N)C(=O)O)ccc1N2c1ccc(OC)cc1,ClCCl,500.0
CCCCCCOc1ccc2c(c1)Sc1cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)c4nsnc34)ccc1N2CCCC,C1CCOC1,462.0
CCCCCCOc1ccc2ccc3oc(=O)cc4cc(OCCCCCC)c1c2c43,CC1CCCO1,477.0
CCCCCCOc1ccc2oc3c(c2c1)=CC1=C(c2ccccc2C)c2cc4c5cc(OCCCCCC)ccc5oc4n2[B-](F)(F)[N+]=31,C1CCCCC1,592.0
CCCCCCOc1ccc2oc3c(c2c1)=CC1=C(c2ccccc2C)c2cc4c5cc(OCCCCCC)ccc5oc4n2[B-](F)(F)[N+]=31,CCOC(C)=O,587.0
CCCCCCOc1ccc2oc3c(c2c1)=CC1=C(c2ccccc2C)c2cc4c5cc(OCCCCCC)ccc5oc4n2[B-](F)(F)[N+]=31,CO,585.0
CCCCCCOc1cccc(-n2c3ccsc3c3sc(-c4ccc(N(c5ccc(-c6cc7c(s6)c6sccc6n7-c6cccc(OCCCCCC)c6)cc5)c5cc6c7cc(-c8cc9c(s8)c8sc(C=C(C#N)C(=O)O)cc8n9-c8cccc(OCCCCCC)c8)ccc7n(CCCCCC)c6cc5OCCCCCC)cc4)cc32)c1,ClCCl,511.0
CCCCCCOc1cccc(OCCCCCC)c1/C1=C2\C=CC(=N2)/C(c2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccc(C(=O)O)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCCCC)cccc1OCCCCCC,ClCCl,594.0
CCCCCCOc1cccc(OCCCCCC)c1/C1=C2\C=CC(=N2)/C(c2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C=C1/C=CC(=N1)/C=3c1c(OCCCCCC)cccc1OCCCCCC,ClCCl,591.0
CCCCCCOc1cccc(OCCCCCC)c1/C1=C2\C=CC(=N2)C(/C=C/C(=O)O)=c2/cc/c3n2[Zn]n2c(ccc21)/C=C1/C=CC(=N1)/C=3c1c(OCCCCCC)cccc1OCCCCCC,ClCCl,611.0
CCCCCCOc1cccc(OCCCCCC)c1N1c2ccc(-c3cc(CCCCCC)c(/C=C(/C#N)C(=O)O)s3)cc2Sc2cc(-c3cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,516.0
CCCCCCOc1cccc(OCCCCCC)c1N1c2ccc(-c3cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s3)cc2Sc2cc(-c3cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,516.0
CCCCCCOc1cccc(OCCCCCC)c1N1c2ccc(-c3nc(CCCCCC)c(/C=C(/C#N)C(=O)O)s3)cc2Sc2cc(-c3nc(CCCCCC)c(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,520.0
CCCCCCOc1cccc(OCCCCCC)c1N1c2ccc(-c3nc(CCCCCC)c(/C=C(\C#N)C(=O)O)s3)cc2Sc2cc(-c3nc(CCCCCC)c(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,520.0
CCCCCCOc1ccccc1/C1=C2\C=CC(=N2)/C(c2ccccc2OCCCCCC)=c2/cc/c3n2[Zn]n2c1ccc2/C(c1ccccc1OCCCCCC)=C1\N=C(C=C1C#Cc1ccc(/C=C(\C#N)C(=O)O)cc1)/C=3c1ccccc1OCCCCCC,C1CCOC1,604.0
CCCCCCSC1=C(SCCCCCC)SC(=C(C(=C2SC(SCCCCCC)=C(SCCCCCC)S2)c2ccc(-c3ccc(-c4ccncc4)s3)cc2)c2ccc(-c3ccc(-c4ccncc4)s3)cc2)S1,C1CCOC1,405.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc(-c3ccc(-c4ccc5c(c4)N(CCCC)c4cc(/C=C(\C#N)C(=O)O)ccc4S5)cc3)cc2)S1,C1CCOC1,382.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc(-c3ccc(-c4ccncc4)s3)cc2)S1,C1CCOC1,407.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6ccc(-c7ccc(/C=C(/C#N)C(=O)O)s7)s6)=C5C(=O)N4CC(CC)CCCC)s3)s2)S1,ClCCl,650.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc(-c3ccc(C4=C5C(=O)N(CC(CC)CCCC)C(c6ccc(-c7ccc(C=C(C#N)C#N)s7)s6)=C5C(=O)N4CC(CC)CCCC)s3)s2)S1,ClCCl,674.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc(-c3ccc4c(c3)N(CCCC)c3cc(/C=C(\C#N)C(=O)O)ccc3S4)c(F)c2)S1,C1CCOC1,383.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc(-c3ccc4c(c3)N(CCCC)c3cc(/C=C(\C#N)C(=O)O)ccc3S4)cc2)S1,C1CCOC1,450.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc(N(c3ccccc3)c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2)S1,CO,417.0
CCCCCCSC1=C(SCCCCCC)SC(=Cc2ccc3c(c2)N(CCCC)c2cc(/C=C(\C#N)C(=O)O)ccc2S3)S1,C1CCOC1,467.0
CCCCCCSC1=C(SCCCCCC)SC(=c2c3ccccc3c(=C3SC(SCCCCCC)=C(SCCCCCC)S3)c3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)ccc23)S1,CN(C)C=O,442.0
CCCCCCSC1=C(SCCCCCC)SC(=c2c3ccccc3c(=C3SC(SCCCCCC)=C(SCCCCCC)S3)c3cc(-c4ccc(-c5ccc(/C=C6\SC(=S)N(CC(=O)O)C6=O)s5)c5nsnc45)ccc23)S1,CN(C)C=O,478.0
CCCCCCSC1=C(SCCCCCC)SC(=c2c3ccccc3c(=C3SC(SCCCCCC)=C(SCCCCCC)S3)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc23)S1,ClCCl,421.0
CCCCCCSC1=C(SCCCCCC)SC(=c2c3ccccc3c(=C3SC(SCCCCCC)=C(SCCCCCC)S3)c3cc(-c4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)cc4)ccc23)S1,CN(C)C=O,385.0
CCCCCCSC1=C(SCCCCCC)SC(=c2c3ccccc3c(=C3SC(SCCCCCC)=C(SCCCCCC)S3)c3cc(-c4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)s4)ccc23)S1,CN(C)C=O,440.0
CCCCCCSC1=C(SCCCCCC)SC(C2c3ccccc3C(C3SC(SCCCCCC)=C(SCCCCCC)S3)c3cc(-c4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)s4)ccc32)S1,CN(C)C=O,440.0
CCCCCCSC1=C(SCCCCCC)SC(C2c3ccccc3C(C3SC(SCCCCCC)=C(SCCCCCC)S3)c3cc(C#Cc4ccc(C=C(C#N)C(=O)O)cc4)ccc32)S1,CN(C)C=O,455.0
CCCCCCSc1ccc(N(c2ccc(SCCCCCC)cc2)c2ccc(-c3sc(C4=C/C(=C5/C=C(c6sc(-c7ccc(C(=O)O)cc7)c(CCCCCC)c6CCCCCC)OC5=O)C(=O)O4)c(CCCCCC)c3CCCCCC)cc2)cc1,ClC(Cl)Cl,651.0
CCCCCCSc1ccc(N(c2ccc(SCCCCCC)cc2)c2ccc(-c3sc(C4=C/C(=C5/C=C(c6sc(-c7ccc(C=C(C#N)C(=O)O)s7)c(CCCCCC)c6CCCCCC)OC5=O)C(=O)O4)c(CCCCCC)c3CCCCCC)cc2)cc1,ClC(Cl)Cl,681.0
CCCCCC[C@H](CCCC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc2c3nonc3c3cc(-c4sc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4C[C@H](CCCC)CCCCCC)sc3c2s1,C1CCOC1,462.0
CCCCCC[C@H](CCCC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc2c3nonc3c3cc(-c4sc(-c5ccc6c(c5)C(CC)(CC)c5cc(N(c7ccccc7)c7ccccc7)ccc5-6)cc4C[C@@H](CCCC)CCCCCC)sc3c2s1,C1CCOC1,462.0
CCCCCC[C@H](CCCC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc2c3nonc3c3cc(-c4sc(-c5ccc6c(c5)Sc5ccccc5N6CC)cc4C[C@H](CCCC)CCCCCC)sc3c2s1,C1CCOC1,464.0
CCCCCC[C@H](CCCC)Cc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc2c3nonc3c3cc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4C[C@H](CCCC)CCCCCC)sc3c2s1,C1CCOC1,462.0
CCCCCC[N+]1=C(/C=C/c2cc3c4c(c2)C(C)(C)c2cccc5c2N4c2c(cccc2C3(C)C)C5(C)C)C(C)(C)c2cc(C(=O)O)ccc21,CO,595.0
CCCCCC[N+]1=C(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)C(C)(C)c2cc(C(=O)O)ccc21,CO,551.0
CCCCCC[N+]1=C(/C=C2/C(=O)C(c3cc4c5c(c3)C(C)(C)c3cccc6c3N5c3c(cccc3C4(C)C)C6(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CC#N,673.0
CCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(N(CCCC)CCCC)cc3)C2[O-])c2ccc(C(=O)O)c3cccc1c23,CN(C)C=O,790.0
CCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(N(CCCC)CCCC)cc3)C2[O-])c2ccc(C(=O)O)c3cccc1c23,CS(C)=O,790.0
CCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(N(CCCC)CCCC)cc3)C2[O-])c2ccc(C(=O)O)c3cccc1c23,ClC(Cl)Cl,790.0
CCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(N(c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4ccccc4-5)c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4ccccc4-5)cc3)C2[O-])c2ccc(C(=O)O)c3cccc1c23,CN(C)C=O,763.0
CCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(N(c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4ccccc4-5)c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4ccccc4-5)cc3)C2[O-])c2ccc(C(=O)O)c3cccc1c23,ClC(Cl)Cl,763.0
CCCCCC[N+]1=C(/C=C2/C(=O)C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CC#N,674.0
CCCCCC[N+]1=C(C=C2C(=O)C(C=C3N(C)c4ccc(C(=O)O)cc4C3(C)C)=C2[O-])C(C)(C)c2ccccc21,ClCCl,641.0
CCCCCC[Si]1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2cc(-c3sc(-c4ccc(N(c5ccc(OCC(CC)CCCC)cc5)c5ccc(OCC(CC)CCCC)cc5)cc4)c4c3OCCO4)sc21,CN(C)C=O,495.0
CCCCCC[Si]1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc21,CCO,481.0
CCCCCC[Si]1(CCCCCC)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,CCO,468.0
CCCCCC[Si]1(CCCCCC)c2cc(C=C(C#N)C(=O)O)sc2-c2sc(-c3sc(-c4ccc(N(c5ccc(OCC(CC)CCCC)cc5)c5ccc(OCC(CC)CCCC)cc5)cc4)c4c3OCCO4)cc21,CN(C)C=O,493.0
CCCCCCc1c(-c2ccc(/C=C(\C#N)C(=O)O)s2)sc(-c2ccc(-c3ccc(-c4cc5sc6ccsc6c5s4)s3)s2)c1CCCCCC,C1CCOC1,440.0
CCCCCCc1c(-c2ccc(OC)cc2)c(-c2ccc(/C=C(\C#N)C(=O)O)s2)n2ccccc12,ClCCl,239.0
CCCCCCc1c(-c2ccccc2)c(-c2ccc(/C=C(\C#N)C(=O)O)s2)n2ccccc12,ClCCl,558.0
CCCCCCc1c(-c2sc(-c3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)c3c2OCCO3)sc2cc(/C=C(\C#N)C(=O)O)sc12,C1CCOC1,481.0
CCCCCCc1c(/C=C(/C#N)C(=O)O)sc2c(CCCCCC)c(-c3sc4c(CCCCCC)c(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6ccccc6-7)c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)sc4c3CCCCCC)sc12,C1CCOC1,372.0
CCCCCCc1c(/C=C(/C#N)C(=O)O)sc2c(CCCCCC)c(/C=C/c3sc4c(CCCCCC)c(-c5cc6ccc(N(c7ccc8c(c7)C(C)(C)c7ccccc7-8)c7ccc8c(c7)C(C)(C)c7ccccc7-8)cc6s5)sc4c3CCCCCC)sc12,C1CCOC1,490.0
CCCCCCc1c(/C=C(/C#N)C(=O)O)sc2c(CCCCCC)c(/C=C/c3sc4c(CCCCCC)c(-c5ccc(N(c6ccc7c(c6)C(C)(C)c6ccccc6-7)c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc5)sc4c3CCCCCC)sc12,C1CCOC1,480.0
CCCCCCc1c(/C=C/c2ccc(/C3=C4\C=CC(=N4)/C(c4c(C)cc(C)cc4C)=c4/cc/c5n4[Zn]n4c3ccc4/C(c3c(C)cc(C)cc3C)=C3/C=CC(=N3)/C=5c3c(C)cc(C)cc3C)cc2)sc(/C=C/c2sc(/C=C(\C#N)C(=O)O)c(CCCCCC)c2CCCCCC)c1CCCCCC,ClCCl,553.0
CCCCCCc1c(C#C/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3ccc(N(c5ccccc5)c5ccccc5)cc3)=C3/C=CC(=N3)/C=4c3ccc(N(c4ccccc4)c4ccccc4)cc3)/C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)=C3/C=CC2=N3)sc(/C=C(\C#N)C(=O)O)c1CCCCCC,C1CCOC1,662.0
CCCCCCc1c(C#C/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3ccc(N(c5ccccc5)c5ccccc5)cc3)=C3/C=CC(=N3)/C=4c3ccc(N(c4ccccc4)c4ccccc4)cc3)/C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)=C3/C=CC2=N3)sc(/C=C/c2sc(/C=C(\C#N)C(=O)O)c(CCCCCC)c2CCCCCC)c1CCCCCC,C1CCOC1,668.0
CCCCCCc1c(C#Cc2ccc(N(C)C)cc2)sc2cc(-c3cc4sc(/C=C(\C#N)C(=O)O)c(CCCCCC)c4s3)sc12,CN(C)C=O,455.0
CCCCCCc1c(C#Cc2ccc(N(C)C)cc2)sc2cc(/C=C(\C#N)C(=O)O)sc12,CN(C)C=O,419.0
CCCCCCc1c(C2=C/C(=C3/C=C(c4sc(-c5ccc(C=C(C#N)C(=O)O)s5)c(CCCCCC)c4CCCCCC)N(CCCCCC)C3=O)C(=O)N2CCCCCC)sc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c1CCCCCC,ClC(Cl)Cl,608.0
CCCCCCc1c(C2=C/C(=C3/C=C(c4sc(-c5ccc(C=C(C#N)C(=O)O)s5)c(CCCCCC)c4CCCCCC)OC3=O)C(=O)O2)sc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c1CCCCCC,ClC(Cl)Cl,676.0
CCCCCCc1c(C=C2C=C(C(C)(C)C)OC(C(C)(C)C)=C2)sc(C=C(C#N)C(=O)O)c1CCCCCC,ClC(Cl)Cl,544.0
CCCCCCc1c(C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)sc(/C=C/c2sc(/C=C(\C#N)C(=O)O)c(CCCCCC)c2CCCCCC)c1CCCCCC,ClCCl,626.0
CCCCCCc1c(C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)sc2c(CCCCCC)c(/C=C(\C#N)C(=O)O)sc12,ClCCl,574.0
CCCCCCc1cc(-c2cc(CCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,CC#N,420.0
CCCCCCc1cc(-c2cc(CCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1ccc2c(c1)c1ccccc1n2-c1ccccc1,CC#N,442.0
CCCCCCc1cc(-c2cc(CCCCCC)c(-c3ccc(N(c4ccc5c(c4)n(CCCCCC)c(=S)n5CCCCCC)c4ccc5c(c4)n(CCCCCC)c(=S)n5CCCCCC)cc3)s2)sc1/C=C(\C#N)C(=O)O,CC#N,440.0
CCCCCCc1cc(-c2cc(CCCCCC)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)sc1/C=C(/C#N)C(=O)O,ClC(Cl)Cl,490.0
CCCCCCc1cc(-c2cc(CCCCCC)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,490.0
CCCCCCc1cc(-c2cc(CCCCCC)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)sc1/C=C(\C#N)C(=O)O,ClCCl,449.0
CCCCCCc1cc(-c2cc3c(-c4ccc(CC(CC)CCCC)s4)c4sc(-c5cc(CCCCCC)c(-c6cc(CCCCCC)c(-c7sc(/C=C(\C#N)C(=O)O)c8c7OCCO8)s6)s5)cc4c(-c4ccc(CC(CC)CCCC)s4)c3s2)sc1-c1cc(CCCCCC)c(-c2sc(/C=C(/C#N)C(=O)O)c3c2OCCO3)s1,C1CCOC1,484.0
CCCCCCc1cc(-c2cc3c(-c4ccc(CC(CC)CCCC)s4)c4sc(-c5cc(CCCCCC)c(-c6cc(CCCCCC)c(-c7sc(/C=C(\C#N)C(=O)O)c8c7OCCO8)s6)s5)cc4c(-c4ccc(CC(CC)CCCC)s4)c3s2)sc1-c1cc(CCCCCC)c(-c2sc(/C=C(\C#N)C(=O)O)c3c2OCCO3)s1,C1CCOC1,484.0
CCCCCCc1cc(-c2cc3c(-c4ccc(CC(CC)CCCC)s4)c4sccc4c(-c4ccc(CC(CC)CCCC)s4)c3s2)sc1-c1cc(CCCCCC)c(-c2sc(/C=C(\C#N)C(=O)O)c3c2OCCO3)s1,C1CCOC1,501.0
CCCCCCc1cc(-c2cc3c4nn(CC(CC)CCCC)nc4c4cc(-c5cc6c(s5)c5ccccc5n6CC(CC)CCCC)sc4c3s2)sc1/C=C(/C#N)C(=O)O,C1CCOC1,469.0
CCCCCCc1cc(-c2cc3c4nn(CC(CC)CCCC)nc4c4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)sc4c3s2)sc1/C=C(/C#N)C(=O)O,C1CCOC1,478.0
CCCCCCc1cc(-c2cc3c4nn(CC(CC)CCCC)nc4c4cc(-c5ccc6c7ccccc7n(CC(CC)CCCC)c6c5)sc4c3s2)sc1/C=C(/C#N)C(=O)O,C1CCOC1,464.0
CCCCCCc1cc(-c2cc3c4nn(C[C@@H](CC)CCCC)nc4c4cc(-c5ccc6c7ccccc7n(C[C@@H](CC)CCCC)c6c5)sc4c3s2)sc1/C=C(\C#N)C(=O)O,C1CCOC1,464.0
CCCCCCc1cc(-c2cc3c4nn(C[C@H](CC)CCCC)nc4c4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)sc4c3s2)sc1/C=C(\C#N)C(=O)O,C1CCOC1,478.0
CCCCCCc1cc(-c2cc3sc(-c4cc(CCCCCC)c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)cc3s2)sc1C=C(C#N)C(=O)O,CCO,450.0
CCCCCCc1cc(-c2cc[n+](C(=O)O)cc2)sc1-c1ccc2c(c1)Sc1ccccc1N2CCCCCC,ClCCl,506.0
CCCCCCc1cc(-c2cc[n+](CC(=O)O)cc2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,455.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4cc5c(s4)c4sccc4n5-c4ccc(OCC(CC)CCCC)cc4)s3)c3nsnc23)sc1-c1ccc(C(=O)O)cc1,ClCCl,518.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)sc1-c1ccc2c(c1)N(c1ccc(C)cc1)C1CCCC21,ClCCl,543.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3nn(CCCCCC)nc23)sc1C=C(C#N)C(=O)O,C1CCOC1,454.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)s3)c3nsnc23)sc1/C=C(/C#N)C(=O)O,ClCCl,557.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc5c(c4)N(c4ccc(C)cc4)C4CCCC54)s3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)sc1/C=C(/C#N)C(=O)O,ClCCl,543.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc5c(c4)c4c(-c6ccccc6)c6c(c(-c7ccccc7)c4n5CCCCCC)c4ccccc4n6CCCCCC)s3)c3nsnc23)sc1/C=C(\C#N)C(=O)O,C1CCOC1,423.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc5c(c4)c4c6c(c7ccccc7n6CC(CC)CCCC)c6c(c7ccccc7n6CC(CC)CCCC)c4n5CC(CC)CCCC)s3)c3nsnc23)sc1/C=C(\C#N)C(=O)O,ClCCl,531.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc5c(c4)c4c6c(c7ccccc7n6CC(CC)CCCC)c6c(c7ccccc7n6CC(CC)CCCC)c4n5CC(CC)CCCC)s3)c3nsnc23)sc1C#Cc1ccc(C(=O)O)cc1,ClCCl,519.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(-c4ccc5c(c4)c4cccc6c4n5-c4ccccc4C6(CC)CC)s3)c3nsnc23)sc1/C=C(\C#N)C(=O)O,C1CCOC1,510.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(/C4=C5\C=CC(=N5)/C(c5ccc(C)cc5)=c5/cc/c6n5[Zn]n5c(ccc54)/C(c4ccc(C)cc4)=C4/C=CC(=N4)/C=6c4ccc(C)cc4)s3)c3nsnc23)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,552.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s3)c3nsnc23)sc1/C=C/c1ccc(N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,574.0
CCCCCCc1cc(-c2ccc(-c3cc(CCCCCC)c(/C=C/c4ccc5c(c4)c4c6c(c7ccccc7n6CC(CC)CCCC)c6c(c7ccccc7n6CC(CC)CCCC)c4n5CC(CC)CCCC)s3)c3nsnc23)sc1C#Cc1ccc(C(=O)O)cc1,ClCCl,544.0
CCCCCCc1cc(-c2ccc(-c3ccc(-c4ccc(N(c5ccc(-c6ccc(OCC(CC)CCCC)cc6)cc5)c5ccc(-c6ccc(OCC(CC)CCCC)cc6)cc5)cc4)s3)c3nsnc23)sc1-c1ccc(/C=C(\C#N)C(=O)O)cc1,C1CCOC1,540.0
CCCCCCc1cc(-c2ccc(-c3ccc(-c4ccc(N(c5ccc(-c6ccc(OCC(CC)CCCCC)cc6)cc5)c5ccc(-c6ccc(OCC(CC)CCCCC)cc6)cc5)cc4)s3)c3nsnc23)sc1-c1ccc(/C=C(\C#N)C(=O)O)cc1,C1CCOC1,524.0
CCCCCCc1cc(-c2ccc(-c3ccc(-c4ccc(N(c5ccc(OCC(CC)CCCC)cc5)c5ccc(OCC(CC)CCCC)cc5)cc4)s3)c3nsnc23)sc1-c1ccc(/C=C(\C#N)C(=O)O)cc1,C1CCOC1,530.0
CCCCCCc1cc(-c2ccc(-c3ccc(-c4ccc(N(c5ccc(OCC(CC)CCCCC)cc5)c5ccc(OCC(CC)CCCCC)cc5)cc4)s3)c3nsnc23)sc1-c1ccc(/C=C(\C#N)C(=O)O)cc1,C1CCOC1,527.0
CCCCCCc1cc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1ccc2c(c1)c1c(-c3ccccc3)c3c(c(-c4ccccc4)c1n2CCCCCC)c1ccccc1n3CCCCCC,C1CCOC1,424.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(N(c5ccccc5)c5ccccc5)ccc3-4)s2)sc1/C=C(\C#N)C(=O)O,Cc1ccccc1,469.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)sc1C=C(C#N)C(=O)O,ClCCl,531.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)c3nsnc23)sc1-c1ccc(C=c2sc(=C(C#N)C#N)[nH]c2=O)s1,ClCCl,538.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)c3nsnc23)sc1/C=C(/C#N)C(=O)O,ClCCl,547.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)Sc3cc(-c5ccc(-c6cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s6)s5)ccc3N4C[C@@H](CC)CCCC)s2)sc1/C=C(/C#N)C(=O)O,C1CCOC1,484.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)Sc3cc(-c5ccc(-c6cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s6)s5)ccc3N4c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)s2)sc1/C=C(\C#N)C(=O)O,C1CCOC1,495.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)Sc3ccccc3N4C[C@@H](CC)CCCC)s2)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,494.0
CCCCCCc1cc(-c2ccc(-c3ccc4c(c3)Sc3ccccc3N4c3ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc3)c3nsnc23)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,422.0
CCCCCCc1cc(-c2ccc(/C=C(/C#N)C(=O)O)s2)sc1-c1ccc2c(c1)c1cc(-c3sc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3CCCCCC)ccc1n2CCCCCC,C1CCOC1,455.0
CCCCCCc1cc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,447.0
CCCCCCc1cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)sc1-c1ccc(/C=C(/C#N)C(=O)O)s1,CS(C)=O,485.0
CCCCCCc1cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)sc1-c1ccc2c(c1)c1cc(-c3sc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3CCCCCC)ccc1n2CCCCCC,C1CCOC1,455.0
CCCCCCc1cc(-c2ccc(/C=C(\C#N)C(=O)O)s2)sc1-c1cccs1,CS(C)=O,451.0
CCCCCCc1cc(-c2ccc(N(c3ccc4c(c3)OCCO4)c3ccc4c(c3)OCCO4)cc2)sc1-c1cc2sc(/C=C(\C#N)C(=O)O)cc2s1,ClCCl,501.0
CCCCCCc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)sc1-c1cc2sc(/C=C(\C#N)C(=O)O)cc2s1,ClCCl,489.0
CCCCCCc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)sc1-c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,ClCCl,505.0
CCCCCCc1cc(-c2ccc(N3c4ccccc4C4C5CCC(C5)C43)cc2)sc1-c1cc2sc(/C=C(/C#N)C(=O)O)cc2s1,ClCCl,489.0
CCCCCCc1cc(-c2ccc(N3c4ccccc4C4C5CCC(C5)C43)cc2)sc1-c1ccc(/C=C(/C#N)C(=O)O)cc1,ClCCl,455.0
CCCCCCc1cc(-c2ccc(N3c4ccccc4C4C5CCC(C5)C43)cc2)sc1-c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,ClCCl,522.0
CCCCCCc1cc(-c2ccc(O)c(C#N)c2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,351.0
CCCCCCc1cc(-c2ccc3[n+](c2)[B-](F)(F)N2C=CC=CC2=C3C#N)sc1-c1ccc2c(c1)Sc1cc(/C=C(/C#N)C(=O)O)ccc1N2CCCCCC,C1CCOC1,475.0
CCCCCCc1cc(-c2ccc3c(-c4ccc(C(C)(C)C)cc4)c4cc(-c5cc(OCCCCC)c(/C=C(/C#N)C(=O)O)s5)ccc4c(-c4ccc(C(C)(C)C)cc4)c3c2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,490.0
CCCCCCc1cc(-c2ccc3c(c2)C(=C(C#N)C#N)c2cc(-c4cc(CCCCCC)c(-c5ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc5)s4)ccc2-3)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,369.0
CCCCCCc1cc(-c2ccc3c(c2)C(=C(C#N)C#N)c2cc(-c4cc(CCCCCC)c(-c5ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc5)s4)ccc2-3)sc1C=C(C#N)C(=O)O,ClC(Cl)Cl,303.0
CCCCCCc1cc(-c2ccc3c(c2)C(=O)c2cc(-c4cc(CCCCCC)c(-c5ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc5)s4)ccc2-3)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,427.0
CCCCCCc1cc(-c2ccc3c(c2)C(=O)c2cc(-c4cc(CCCCCC)c(-c5ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc5)s4)ccc2-3)sc1C=C(C#N)C#N,ClC(Cl)Cl,368.0
CCCCCCc1cc(-c2ccc3c(c2)C(=O)c2cc(-c4cc(CCCCCC)c(-c5ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc5)s4)ccc2-3)sc1C=C(C#N)C(=O)O,ClC(Cl)Cl,303.0
CCCCCCc1cc(-c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)sc1-c1ccc(/C=C(\C#N)C(=O)O)s1,Cc1ccccc1,452.0
CCCCCCc1cc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc2-3)sc1/C=C(/C#N)C(=O)O,ClC(Cl)Cl,450.0
CCCCCCc1cc(-c2ccc3c(c2)C2CCCC2N3c2ccc(C)cc2)sc1/C=C(/C#N)C(=O)O,ClC(Cl)Cl,480.0
CCCCCCc1cc(-c2ccc3c(c2)C2CCCC2N3c2ccc3c(c2)C(C)(C)c2ccccc2-3)sc1C=C1C(=O)c2cc(C(=O)O)ccc2C1=C(C#N)C#N,ClC(Cl)Cl,709.0
CCCCCCc1cc(-c2ccc3c(c2)C2CCCC2N3c2ccc3c(c2)C(C)(C)c2ccccc2-3)sc1C=C1C(=O)c2cc(C(=O)O)ccc2S1(=O)=O,ClC(Cl)Cl,614.0
CCCCCCc1cc(-c2ccc3c(c2)C2CCCC2N3c2ccc3c(c2)C(C)(C)c2ccccc2-3)sc1C=C1C(=O)c2ccc(C(=O)O)cc2C1=O,ClC(Cl)Cl,610.0
CCCCCCc1cc(-c2ccc3c(c2)N(c2ccccc2)C2C4CCC(C4)C32)sc1-c1ccc(/C=C(\C#N)C(=O)O)s1,ClCCl,529.0
CCCCCCc1cc(-c2ccc3c(c2)N(c2ccccc2)C2C4CCC(C4)C32)sc1-c1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)s1,ClCCl,542.0
CCCCCCc1cc(-c2ccc3c(c2)Sc2cc(-c4cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s4)ccc2N3C[C@@H](CC)CCCC)sc1/C=C(/C#N)C(=O)O,C1CCOC1,475.0
CCCCCCc1cc(-c2ccc3c(c2)Sc2cc(-c4cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s4)ccc2N3c2ccc(/C(=C/c3ccccc3)c3ccccc3)cc2)sc1/C=C(\C#N)C(=O)O,C1CCOC1,495.0
CCCCCCc1cc(-c2ccc3c(c2)Sc2cc(-c4cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s4)ccc2N3c2ccc(C(=C(c3ccccc3)c3ccccc3)c3ccccc3)cc2)sc1/C=C(\C#N)C(=O)O,C1CCOC1,496.0
CCCCCCc1cc(-c2ccc3c(c2)Sc2cc(/C=C(/C#N)C(=O)O)ccc2N3CCCCCC)sc1-c1ccc2[n+](c1)[B-](F)(F)N1C=CC=CC1=C2C#N,C1CCOC1,465.0
CCCCCCc1cc(-c2ccc3c(c2)Sc2cc(/C=C(/C#N)C(=O)O)ccc2N3c2ccc(-c3ccc4[n+](c3)[B-](F)(F)N3C=CC=CC3=C4C#N)cc2)sc1-c1ccc2[n+](c1)[B-](F)(F)N1C=CC=CC1=C2C#N,C1CCOC1,460.0
CCCCCCc1cc(-c2ccc3c(c2)c2ccccc2n3CC)sc1-c1sc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1CCCCCC,ClCCl,440.0
CCCCCCc1cc(-c2ccc3c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4n(CC)c3c2)sc1/C=C(/C#N)C(=O)O,ClC(Cl)Cl,469.0
CCCCCCc1cc(-c2ccc3c[n+](CC(=O)O)ccc3c2)sc1-c1ccc(N(c2ccc(-c3ccc(OCCCC)cc3OCCCC)cc2)c2ccc(-c3ccc(OCCCC)cc3OCCCC)cc2)cc1,ClC(Cl)Cl,474.0
CCCCCCc1cc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nn(CCCCCC)nc23)sc1C=C(C#N)C(=O)O,C1CCOC1,486.0
CCCCCCc1cc(-c2nc3sc(-c4cc(CCCCCC)c(-c5ccc(C=C(C#N)C(=O)O)s5)s4)nc3s2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,472.0
CCCCCCc1cc(-c2ncc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)c3nsnc23)sc1-c1ccc(C=c2sc(=C(C#N)C#N)[nH]c2=O)s1,ClCCl,582.0
CCCCCCc1cc(-c2sc(-c3cc4c(s3)c3ccccc3n4CC)cc2CCCCCC)sc1/C=C(\C#N)C(=O)O,Cc1ccccc1,502.0
CCCCCCc1cc(-c2sc(-c3cc4c(s3)c3ccccc3n4CC)cc2CCCCCC)sc1C=C(C#N)C(=O)O,Cc1ccccc1,502.0
CCCCCCc1cc(-c2sc(-c3ccc(/C=C(\C#N)C(=O)O)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2CCCCCC)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,483.0
CCCCCCc1cc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2CCCCCC)sc1/C=C(\C#N)C(=O)O,ClCCl,498.0
CCCCCCc1cc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2CCCCCC)sc1C=C(C#N)C(=O)O,CCO,497.0
CCCCCCc1cc(-c2sc(-c3ccc4c[n+](CC(=O)O)ccc4c3)cc2CCCCCC)sc1-c1ccc(N(c2ccc(OCCCC)cc2)c2ccc(OCCCC)cc2)cc1,ClCCl,481.0
CCCCCCc1cc(-c2sc(-c3ccc4c[n+](CCCC(=O)O)ccc4c3)cc2CCCCCC)sc1-c1ccc(N(c2ccc(OCCCC)cc2)c2ccc(OCCCC)cc2)cc1,ClCCl,479.0
CCCCCCc1cc(-c2sc(-c3sc(-c4cc(CCCCCC)c(-c5cc(CCCCCC)c(-c6ccc7c(=O)n8c9ccccc9nc8c8cccc6c78)s5)s4)c(CCCCCC)c3CCCCCC)cc2CCCCCC)sc1-c1ccc(N(c2ccc(C(=O)O)cc2)c2ccc(C(=O)O)cc2)cc1,ClCCl,404.0
CCCCCCc1cc(-c2sc(-c3sc(-c4cc5c(s4)c4ccccc4n5CC)cc3CCCCCC)cc2CCCCCC)sc1/C=C(\C#N)C(=O)O,Cc1ccccc1,496.0
CCCCCCc1cc(-c2sc(-c3sc(-c4ccc5c(c4)c4ccccc4n5CC)cc3CCCCCC)cc2CCCCCC)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,471.0
CCCCCCc1cc(-c2sc(-c3sc(-c4ccc5c6ccccc6n(CC)c5c4)cc3CCCCCC)cc2CCCCCC)sc1/C=C(\C#N)C(=O)O,Cc1ccccc1,492.0
CCCCCCc1cc(-c2sc(-c3sc(-c4ccc5c[n+](CC(=O)O)ccc5c4)cc3CCCCCC)cc2CCCCCC)sc1-c1ccc(N(c2ccc(-c3ccc(OCCCC)cc3OCCCC)cc2)c2ccc(-c3ccc(OCCCC)cc3OCCCC)cc2)cc1,ClC(Cl)Cl,485.0
CCCCCCc1cc(-c2sc(-c3sc(-c4ccc5c[n+](CC(=O)O)ccc5c4)cc3CCCCCC)cc2CCCCCC)sc1-c1ccc(N(c2ccc(OCCCC)cc2)c2ccc(OCCCC)cc2)cc1,ClC(Cl)Cl,493.0
CCCCCCc1cc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)sc1/C=C(\C#N)C(=O)Cc1ccc([Si](OC)(OC)OC)cc1,ClC(Cl)Cl,507.0
CCCCCCc1cc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)sc1/C=C(\C#N)C(=O)Nc1ccc(C(=O)O)cc1,Cc1ccccc1,504.0
CCCCCCc1cc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)sc1/C=C(\C#N)C(=O)Nc1ccc([Si](OC)(OC)OC)cc1,Cc1ccccc1,498.0
CCCCCCc1cc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)sc1C=C(C#N)C(=O)NCC(=O)O,Cc1ccccc1,485.0
CCCCCCc1cc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)sc1C=C(C#N)C(=O)NCCC(=O)O,Cc1ccccc1,480.0
CCCCCCc1cc(-c2sc(-c3sc(-c4sc(-c5ccc6c(c5)c5ccccc5n6CC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)sc1C=C(C#N)C(=O)O,Cc1ccccc1,495.0
CCCCCCc1cc(-c2sc(-c3sc(-c4sc(/C=C(/C#N)C(=O)O)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)sc1-c1ccc2c(c1)c1ccccc1n2CC,ClC(Cl)Cl,473.0
CCCCCCc1cc(-c2sc(-c3sc(/C=C(\C#N)C(=O)O)cc3CCCCCC)cc2CCCCCC)sc1-c1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1,C1CCOC1,430.0
CCCCCCc1cc(-c2sc(-c3sc(/C=C(\C#N)C(=O)O)cc3CCCCCC)cc2CCCCCC)sc1-c1ccc2c(c1)c1ccccc1n2CC,ClC(Cl)Cl,453.0
CCCCCCc1cc(-c2sc(/C=C(/C#N)C(=O)O)cc2CCCCCC)sc1-c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1,C1CCOC1,469.0
CCCCCCc1cc(-c2sc(/C=C(\C#N)C(=O)O)cc2CCCCCC)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,475.0
CCCCCCc1cc(-c2sc(/C=C3/SC(=S)N(CC(=O)O)C3=O)cc2CCCCCC)sc1-c1ccc(N(c2ccc(OCCCC)cc2)c2ccc(OCCCC)cc2)cc1,ClCCl,534.0
CCCCCCc1cc(-c2sc(/C=C3/SC(=S)N(CCC(=O)O)C3=O)cc2CCCCCC)sc1-c1ccc(N(c2ccc(OCCCC)cc2)c2ccc(OCCCC)cc2)cc1,ClCCl,505.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3cc(CCCCCC)c(-c4ccc(-c5sc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5CCCCCC)s4)s3)cc2CCCCCC)s1,ClC(Cl)Cl,464.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc(N(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1,C1CCOC1,452.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc2c(c1)C1=Cc3c4cc(-c5sc(/C=C(/C#N)C(=O)O)cc5CCCCCC)ccc4c(-c4ccccc4OC)n3[B-](F)(F)[N+]1=C2c1ccccc1OC,C1CCOC1,660.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc2c(c1)C1=Cc3c4cc(-c5sc(/C=C(\C#N)C(=O)O)cc5CCCCCC)ccc4c(-c4ccccc4OC)n3[B-](F)(F)[N+]1=C2c1ccccc1OC,C1CCOC1,660.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc2c(c1)C1CCCC1N2c1ccc(C=C(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,523.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc2c3n(c(-c4ccccc4OC)c2c1)[B-](F)(F)[N+]1=C(c2ccccc2OC)c2cc(-c4sc(CO)cc4CCCCCC)ccc2C1=C3,C1CCOC1,644.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1sc(-c2ccc(N(c3ccc4c(c3)n(CCCCCC)c(=S)n4CCCCCC)c3ccc4c(c3)n(CCCCCC)c(=S)n4CCCCCC)cc2)cc1CCCCCC,ClCCl,458.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1-c1sc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1CCCCCC,ClCCl,446.0
CCCCCCc1cc(/C=C(/C#N)C(=O)O)sc1/C=C/c1ccc(N(c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)cc1,CCO,456.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1cc(CCCCCC)c(-c2cc(CCCCCC)c(-c3cc4cc(-c5ccccc5)c5c6ccccc6n(CC)c5c4s3)s2)s1,ClC(Cl)Cl,464.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2ccc(-c3sc(-c4cc5sc6ccsc6c5s4)cc3CCCCCC)s2)s1,C1CCOC1,440.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3cc(CCCCCC)c(-c4ccc(-c5sc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5CCCCCC)s4)s3)cc2CCCCCC)s1,ClC(Cl)Cl,464.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3cc4ccccc4c4ccccc34)cc2CCCCCC)s1,ClC(Cl)Cl,471.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2CCCCCC)s1,ClC(Cl)Cl,489.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc4c(c3)c3ccc5c6ccccc6n(CC(CC)CCCC)c5c3n4CC(CC)CCCC)cc2CCCCCC)s1,ClC(Cl)Cl,479.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc4c(c3)c3ccccc3n4CC)cc2CCCCCC)s1,ClC(Cl)Cl,492.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc4c5c(cccc35)-c3ccccc3-4)cc2CCCCCC)s1,ClC(Cl)Cl,472.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc4sc5ccccc5c4c3)cc2CCCCCC)s1,ClC(Cl)Cl,477.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,461.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc(N2c3ccc(cc3)/C=C\c3ccc(cc3)N(c3ccccc3)c3ccc(cc3)/C=C\c3ccc2cc3)cc1,ClCCl,450.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1ccc2c3n(c(-c4ccccc4OC)c2c1)[B-](F)(F)[N+]1=C(c2ccccc2OC)c2cc(-c4sc(CO)cc4CCCCCC)ccc2C1=C3,C1CCOC1,644.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1sc(-c2ccc(-c3ccc4c(c3)N(c3ccc(C)cc3)C3CCCC43)c3nsnc23)cc1CCCCCC,ClCCl,513.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1sc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1CCCCCC,ClCCl,433.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1-c1sc(-c2ccc3c(c2)c2cc(C(C)(C)C)ccc2n3-c2ccc(C(C)(C)C)cc2)cc1CCCCCC,C1CCOC1,417.0
CCCCCCc1cc(/C=C(\C#N)C(=O)O)sc1/C1=C2\C=CC(=N2)/C(c2ccc(C)s2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccc(C)s1)=C1/C=CC(=N1)/C=3c1ccc(C)s1,ClC(Cl)Cl,558.0
CCCCCCc1cc(B(c2c(C)cc(C)cc2C)c2c(C)cc(C)cc2C)c(-c2sc(CCCCCC)cc2P(=O)(c2ccccc2)c2ccccc2)s1,CO,418.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1cc(CCCCCC)c(-c2cc(CCCCCC)c(-c3cc4c(cc(-c5ccccc5)c5c6ccccc6n(CC)c45)s3)s2)s1,ClC(Cl)Cl,476.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc(-n4c5ccc(-c6ccc(C=Cc7ccc(N(c8ccccc8)c8ccccc8)cc7)cc6)cc5c5cc(-c6ccc(C=Cc7ccc(N(c8ccccc8)c8ccccc8)cc7)cc6)ccc54)cc3)cc2CCCCCC)c2nsnc12,CN(C)C=O,376.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc(N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)cc2CCCCCC)c2nsnc12,CCO,468.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2CCCCCC)s1,ClC(Cl)Cl,489.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(C=C2c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3-c3cc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc32)s1,ClCCl,416.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(C=C2c3ccc(N(c4ccccc4)c4ccccc4)cc3-c3cc(N(c4ccccc4)c4ccccc4)ccc32)s1,ClCCl,422.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,461.0
CCCCCCc1cc(C=C(C#N)C(=O)O)sc1C=Cc1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,535.0
CCCCCCc1cc2/c(=C(\C#N)C(=O)OC)s/c(=c3/s/c(=C(/C#N)C(=O)OC)c4cc(CCCCCC)sc34)c2s1,Cc1ccccc1,580.0
CCCCCCc1cc2c(=S)c3cc(CCCCCC)cc4c(=S)c5cc(CCCCCC)cc6c(=S)c(c1)c2n(c34)c65,ClCCl,572.0
CCCCCCc1cc2c(s1)-c1cc3c(cc1NB2c1ccccc1)-c1sc(CCCCCC)cc1B(c1ccccc1)N3,ClCCl,412.0
CCCCCCc1cc2c(s1)-c1ccccc1N1B2c2cc(CCCCCC)sc2-c2cc3c(cc21)-c1sc(CCCCCC)cc1B1c2cc(CCCCCC)sc2-c2cc4c(cc2N13)-c1sc(CCCCCC)cc1B1c2cc(CCCCCC)sc2-c2cc3c(cc2N14)-c1sc(CCCCCC)cc1B1c2cc(CCCCCC)sc2-c2ccccc2N13,C1CCOC1,420.0
CCCCCCc1cc2c(s1)-c1ccccc1N1B2c2cc(CCCCCC)sc2-c2cc3c(cc21)-c1sc(CCCCCC)cc1B1c2cc(CCCCCC)sc2-c2ccccc2N13,C1CCOC1,415.0
CCCCCCc1cc2c(s1)-c1ccccc1N1B2c2cc(CCCCCC)sc2-c2ccccc21,C1CCOC1,357.0
CCCCCCc1cc2c(s1)-c1sc(CCCCCC)cc1P(c1ccccc1)(c1ccccc1)=[O+][B-]2(c1c(C)cc(C)cc1C)c1c(C)cc(C)cc1C,C1CCOC1,431.0
CCCCCCc1cc2c(s1)c1sc(-c3cc4c(s3)c3sc(/C=C(\C#N)C(=O)O)cc3n4CCCCCC)cc1n2CCCCCC,ClCCl,499.0
CCCCCCc1cc2c3c(c1)c(=C(c1ccccc1)c1ccccc1)c1cc(CCCCCC)cc4c1-n-3-c1c(cc(CCCCCC)cc1c4=C(c1ccccc1)c1ccccc1)c2=C(c1ccccc1)c1ccccc1,ClCCl,405.0
CCCCCCc1cc2c3c(c1)c(=C1c4ccccc4S(=O)(=O)c4ccccc41)c1cc(CCCCCC)cc4c1-n-3-c1c(cc(CCCCCC)cc1c4=C1c3ccccc3S(=O)(=O)c3ccccc31)c2=C1c2ccccc2S(=O)(=O)c2ccccc21,ClCCl,449.0
CCCCCCc1cc2c3c(c1)c(=C1c4ccccc4Sc4ccccc41)c1cc(CCCCCC)cc4c1-n-3-c1c(cc(CCCCCC)cc1c4=C1c3ccccc3Sc3ccccc31)c2=C1c2ccccc2Sc2ccccc21,ClCCl,430.0
CCCCCCc1cc2sc(-c3ccc4c(c3)c3cc(-c5cc6sc(CCCCCC)cc6s5)ccc3n4-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(/C=C(\C#N)c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc3-4)cc2s1,ClCCl,474.4
CCCCCCc1cc2sc(/C=C/C3=[N+]4C(=C(c5ccc(C(=O)O)cc5)c5c(C)cc(/C=C/c6cc7sc(CCCCCC)cc7s6)n5[B-]4(C#CCOCCOC)C#CCOCCOC)C(C)=C3)cc2s1,C1CCOC1,695.0
CCCCCCc1ccc(-c2cc(/C3=C4\C=CC(=N4)/C(C#Cc4ccc(C(=O)O)cc4)=c4/cc/c5n4[Zn]n4c(ccc43)/C(C#Cc3ccc(N(C)C)cc3)=C3/C=CC(=N3)/C=5c3cc(-c4ccc(CCCCCC)s4)cc(-c4ccc(CCCCCC)s4)c3)cc(-c3ccc(CCCCCC)s3)c2)s1,C1CCOC1,461.0
CCCCCCc1ccc(-c2cc(CCCCCC)c(-c3ccc(-c4ccc(-c5sc(-c6ccc(P(=O)(O)O)s6)cc5CCCCCC)s4)s3)s2)s1,ClC(Cl)Cl,426.0
CCCCCCc1ccc(-c2cc3c4c(c2)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(CCCCCC)s5)cc5c2N4c2c(cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc2C5(c2ccc(C)cc2)c2ccc(C)cc2)C3(c2ccc(C)cc2)c2ccc(C)cc2)s1,ClC(Cl)Cl,496.0
CCCCCCc1ccc(-c2cc3c4c(c2)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(CCCCCC)s5)cc5c2N4c2c(cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc2C5(c2ccc(C)cc2)c2ccc(C)cc2)C3(c2ccc(C)cc2)c2ccc(C)cc2)s1,ClCCl,496.0
CCCCCCc1ccc(-c2ccc(-c3cc4sc(C=C(C#N)C(=O)O)cc4s3)s2)s1,CCO,433.0
CCCCCCc1ccc(-c2ccc(-c3ccc(N(c4ccc(/C=C(/C#N)C(=O)O)cc4)c4ccc(-c5ccc(-c6ccc(CCCCCC)s6)s5)cc4)cc3)s2)s1,ClC(Cl)Cl,468.0
CCCCCCc1ccc(-c2ccc(-c3ccc(N(c4ccc(/C=C5/SC(=S)N(CC(=O)O)C5=O)cc4)c4ccc(-c5ccc(-c6ccc(CCCCCC)s6)s5)cc4)cc3)s2)s1,ClC(Cl)Cl,494.0
CCCCCCc1ccc(-c2ccc(-c3ccc4c(c3)N(CC(CC)CCCC)C(=O)/C4=C3/C(=O)N(CC(CC)CCCC)c4c3cccc4-c3sc(-c4ccc(P(=O)(O)O)s4)cc3CCCCCC)s2)s1,ClC(Cl)Cl,580.0
CCCCCCc1ccc(-c2ccc(-c3ccc4c(c3)N(CC(CC)CCCC)C(=O)/C4=C3/C(=O)N(CC(CC)CCCC)c4cc(-c5cc(CCCCCC)c(-c6ccc(P(=O)(O)O)s6)s5)ccc43)s2)s1,ClC(Cl)Cl,580.0
CCCCCCc1ccc(-c2ccc(-c3ccc4c(c3)Oc3cc(/C=C(\C#N)C(=O)O)ccc3N4CCCCCC)s2)s1,C1CCOC1,467.0
CCCCCCc1ccc(-c2ccc(-c3ccc4c(c3)Oc3cc(C=C(C#N)C(=O)O)ccc3N4CCCCCC)s2)s1,C1CCOC1,467.0
CCCCCCc1ccc(-c2ccc(-c3ccc4c(c3)Sc3cc(/C=C(\C#N)C(=O)O)ccc3N4CCCCCC)s2)s1,ClCCl,470.0
CCCCCCc1ccc(-c2ccc(-c3ccc4c(c3)Sc3cc(C=C(C#N)C(=O)O)ccc3N4CCCCCC)s2)s1,C1CCOC1,449.0
CCCCCCc1ccc(-c2ccc(/C=C/C3=[N+]4C(=C(c5ccc(C(=O)O)cc5)c5c(C)cc(/C=C/c6ccc(-c7ccc(CCCCCC)s7)s6)n5[B-]4(C#CCOCCOC)C#CCOCCOC)C(C)=C3)s2)s1,C1CCOC1,710.0
CCCCCCc1ccc(-c2ccc(N(c3ccc(-c4cc5sc(/C=C(/C#N)C(=O)O)cc5s4)cc3)c3ccc(-c4cc5sc(/C=C(\C#N)C(=O)O)cc5s4)cc3)cc2)s1,CCO,469.0
CCCCCCc1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(CCCCCC)s4)cc3)cc2)s1,ClCCl,493.0
CCCCCCc1ccc(-c2ccc(N(c3ccc(-c4ccc(C=c5sc(=C(C#N)C#N)[nH]c5=O)s4)cc3)c3ccc(-c4ccc(CCCCCC)s4)cc3)cc2)s1,ClCCl,526.0
CCCCCCc1ccc(-c2ccc3c(c2)Oc2cc(/C=C(\C#N)C(=O)O)ccc2N3CCCCCC)s1,C1CCOC1,465.0
CCCCCCc1ccc(-c2ccc3c(c2)Oc2cc(C=C(C#N)C(=O)O)ccc2N3CCCCCC)s1,C1CCOC1,465.0
CCCCCCc1ccc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3CCCCCC)s1,ClCCl,457.0
CCCCCCc1ccc(-c2ccc3c(c2)Sc2cc(C=C(C#N)C(=O)O)ccc2N3CCCCCC)s1,C1CCOC1,444.0
CCCCCCc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(CCCCCC)s4)ccc2n3-c2ccc3c(c2)C(CCCCCC)(CCCCCC)c2cc(/C=C(\C#N)c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)s1,ClCCl,476.2
CCCCCCc1ccc(-c2sc(-c3ccc(-c4cc(CCCCCC)c(-c5ccc(P(=O)(O)O)s5)s4)c4nsnc34)cc2CCCCCC)s1,CCO,511.0
CCCCCCc1ccc(-c2sc(-c3ccc(-c4cc(CCCCCC)c(-c5ccc(P(=O)(O)O)s5)s4)c4nsnc34)cc2CCCCCC)s1,ClC(Cl)Cl,504.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2cc(-n4c5ccccc5c5ccccc54)ccc2-3)cc1,C1CCOC1,370.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2cc(-n4c5ccccc5c5ccccc54)ccc2-3)cc1,CC#N,369.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2cc(-n4c5ccccc5c5ccccc54)ccc2-3)cc1,Cc1ccccc1,375.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2cc(-n4c5ccccc5c5ccccc54)ccc2-3)cc1,ClCCl,372.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2ccccc2-3)cc1,C1CCOC1,359.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2ccccc2-3)cc1,CC#N,359.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2ccccc2-3)cc1,Cc1ccccc1,361.0
CCCCCCc1ccc(-n2c3[n+](c4c5ccccc5c5ccccc5c42)[B-](C)(C)c2ccccc2-3)cc1,ClCCl,361.0
CCCCCCc1ccc(-n2c3c(c4c2c2c(n4-c4ccc(CCCCCC)cc4)-c4cccc(OC)c4NB2c2ccccc2)B(c2ccccc2)Nc2c(OC)cccc2-3)cc1,Cc1ccccc1,382.0
CCCCCCc1ccc(-n2c3c4cccc(OC)c4nc(-c4ccc(C)cc4)c3c3c2c2c(-c4ccc(C)cc4)nc4c(OC)cccc4c2n3-c2ccc(CCCCCC)cc2)cc1,ClC(Cl)Cl,315.0
CCCCCCc1ccc(-n2c3c4cccc(OC)c4nc(-c4ccc(OC)cc4)c3c3c2c2c(-c4ccc(OC)cc4)nc4c(OC)cccc4c2n3-c2ccc(CCCCCC)cc2)cc1,ClC(Cl)Cl,317.0
CCCCCCc1ccc(-n2c3c4cccc(OC)c4nnc3c3c2c2nnc4c(OC)cccc4c2n3-c2ccc(CCCCCC)cc2)cc1,Cc1ccccc1,392.0
CCCCCCc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(CCCCCC)s3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(/C=C(\C#N)C(=O)O)s2)=C2/C=CC(=N2)/C=4c2ccc(CCCCCC)s2)s1,ClC(Cl)Cl,560.0
CCCCCCc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(/C=C(\C#N)C(=O)O)cc4)c4c(C)cc(/C=C/c5ccc(CCCCCC)s5)n4[B-]3(C#CCOCCOC)C#CCOCCOC)C(C)=C2)s1,C1CCOC1,668.0
CCCCCCc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(C(=O)O)cc4)c4c(C)cc(/C=C/c5ccc(CCCCCC)s5)n4[B-]3(C#CCOCCOC)C#CCOCCOC)C(C)=C2)s1,C1CCOC1,581.0
CCCCCCc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(C(=O)O)cc4)c4c(C)cc(/C=C/c5ccc(CCCCCC)s5)n4[B-]3(F)F)C(C)=C2)s1,C1CCOC1,665.0
CCCCCCc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(C(=O)O)cc4)c4c(C)cc(C)n4[B-]3(C#CCOCCOC)C#CCOCCOC)C(C)=C2)s1,C1CCOC1,666.0
CCCCCCc1ccc(/C=C/C2=[N+]3C(C(C)=C2)C(c2ccc(C(=O)O)cc2)c2c(C)cc(C)n2[B-]3(C#CCOCCOC)C#CCOCCOC)s1,CCO,581.0
CCCCCCc1ccc(/C=C/c2cc(/C=C(\C#N)C(=O)O)sc2-c2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)s1,ClC(Cl)Cl,497.0
CCCCCCc1ccc(/C=C/c2ccc(CCCCCC)s2)s1,Cc1ccccc1,356.0
CCCCCCc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,428.0
CCCCCCc1ccc(C2(c3ccc(CCCCCC)cc3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3sc(-c4cc5c(s4)/C(=C4\C(=O)N(CC(CC)CCCC)c6cc(-c7ccc(/C=C(\C#N)C(=O)O)cc7)ccc64)C(=O)N5CC(CC)CCCC)cc32)cc1,ClCCl,389.0
CCCCCCc1ccc(C2(c3ccc(CCCCCC)cc3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3sc(-c4cc5c(s4)/C(=C4\C(=O)N(CC(CC)CCCC)c6cc(-c7ccc(/C=C(\C#N)C(=O)O)cc7)sc64)C(=O)N5CC(CC)CCCC)cc32)cc1,ClCCl,408.0
CCCCCCc1ccc(C2(c3ccc(CCCCCC)cc3)c3cc(N(c4ccccc4)c4ccccc4)ccc3-c3sc(-c4ccc5c(c4)N(CC(CC)CCCC)C(=O)/C5=C4/C(=O)N(CC(CC)CCCC)c5cc(-c6ccc(C=C(C#N)C(=O)O)cc6)ccc54)cc32)cc1,ClCCl,376.0
CCCCCCc1ccc(N(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(N(c3cccc(CCCCCC)c3)c3cccc(CCCCCC)c3)=C3/C=CC(=N3)/C=4C#Cc3ccc(C(=O)O)cc3)/C(C#Cc3ccc(N(c4ccc(OC)cc4)c4cccc(OC)c4)cc3)=C3/C=CC2=N3)c2ccc(CCCCCC)cc2)cc1,C1CCOC1,707.0
CCCCCCc1ccc(N(c2ccc(C=NN(c3ccccc3)c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)cc2)c2ccc(CCCCCC)cc2)cc1,ClC(Cl)Cl,498.0
CCCCCCc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)cc3Sc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc32)cc1,CN(C)C=O,436.0
CCCCCCc1ccc(N2c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3Sc3cc(-c4ccc(/C=C(/C#N)C(=O)O)s4)ccc32)cc1,CN(C)C=O,445.0
CCCCCCc1ccc(N2c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3Sc3cc(-c4ccc(C=C(C#N)C(=O)O)s4)ccc32)cc1,CN(C)C=O,445.0
CCCCCCc1ccc2c(/C=N/c3cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)c3)c(O)ccc2c1,C1CCOC1,477.0
CCCCCCc1ccc2c(/C=N/c3cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)c3)c(O)ccc2c1,CC#N,474.0
CCCCCCc1ccc2c(/C=N/c3cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)c3)c(O)ccc2c1,Cc1ccccc1,480.0
CCCCCCc1ccc2c(/C=N/c3cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)cc(/N=C/c4c(O)ccc5cc(CCCCCC)ccc45)c3)c(O)ccc2c1,ClCCl,479.0
CCCCCCc1ccc2c(c1)C(C)(C)c1cc(N(c3ccc(-c4sc(-c5cc6sc(/C=C(\C#N)C(=O)O)c(CCCCCC)c6s5)c5c4OCCO5)cc3)c3ccc4c(c3)C(C)(C)c3cc(CCCCCC)ccc3-4)ccc1-2,C1CCOC1,476.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](F)(F)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(F)F)cc1)=C3,C1CCOC1,425.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](F)(F)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(F)F)cc1)=C3,CC#N,422.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](F)(F)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(F)F)cc1)=C3,Cc1ccccc1,436.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](F)(F)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(F)F)cc1)=C3,ClCCl,430.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)c1)=C3,C1CCOC1,445.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)c1)=C3,CC#N,440.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)c1)=C3,Cc1ccccc1,453.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)c1)=C3,ClCCl,450.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc1)=C3,C1CCOC1,455.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc1)=C3,CC#N,452.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc1)=C3,Cc1ccccc1,462.0
CCCCCCc1ccc2c3c(ccc2c1)O[B-](c1ccccc1)(c1ccccc1)[N+](c1ccc([N+]2=Cc4c(ccc5cc(CCCCCC)ccc45)O[B-]2(c2ccccc2)c2ccccc2)cc1)=C3,ClCCl,459.0
CCCCCCc1ccsc1-c1cc(CCCCCC)c(-c2cc(CCCCCC)c(-c3cc(CCCCCC)c(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)s2)s1,ClCCl,478.0
CCCCCCc1ccsc1-c1cc2c3c(c1)C(c1ccc(C)cc1)(c1ccc(C)cc1)c1cc(-c4sccc4CCCCCC)cc4c1N3c1c(cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc1C4(c1ccc(C)cc1)c1ccc(C)cc1)C2(c1ccc(C)cc1)c1ccc(C)cc1,ClC(Cl)Cl,499.0
CCCCCCc1ccsc1-c1cc2c3c(c1)C(c1ccc(C)cc1)(c1ccc(C)cc1)c1cc(-c4sccc4CCCCCC)cc4c1N3c1c(cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc1C4(c1ccc(C)cc1)c1ccc(C)cc1)C2(c1ccc(C)cc1)c1ccc(C)cc1,ClCCl,499.0
CCCCCCc1ccsc1-c1cc2c3cc(-c4sccc4CCCCCC)c4nc(C(F)(F)C(F)(F)C(F)(F)F)nc5c(-c6sccc6CCCCCC)cc(c6cc(-c7sccc7CCCCCC)c7nc(C(F)(F)C(F)(F)C(F)(F)F)nc1c7c26)c3c45,C1CCOC1,521.0
CCCCCCc1ccsc1-c1ccc(-c2ccc(-c3sc(-c4cc(CCCCCC)c(-c5ccc(-c6ccc(-c7sc(-c8cc(CCCCCC)c(-c9ccc(-c%10ccc(-c%11sc(/C=C(\C#N)C(=O)O)cc%11CCCCCC)s%10)s9)s8)cc7CCCCCC)s6)s5)s4)cc3CCCCCC)s2)s1,ClC(Cl)Cl,467.0
CCCCCCc1ccsc1-c1ccc(-c2ccc(-c3sc(-c4cc(CCCCCC)c(-c5ccc(-c6ccc(-c7sc(/C=C(\C#N)C(=O)O)cc7CCCCCC)s6)s5)s4)cc3CCCCCC)s2)s1,ClC(Cl)Cl,465.0
CCCCCCc1ccsc1-c1ccc(-c2sc(C(=O)O)cc2CCCCCC)s1,CC(C)=O,361.0
CCCCCCc1ccsc1-c1ccc(-c2sc(C(=O)O)cc2CCCCCC)s1,CCCCCC,357.0
CCCCCCc1ccsc1-c1ccc(-c2sc(C(=O)O)cc2CCCCCC)s1,CCO,352.0
CCCCCCc1ccsc1-c1ccc(-c2sc(C(=O)O)cc2CCCCCC)s1,CO,352.0
CCCCCCc1ccsc1-c1ccc(-c2sc(C(=O)O)cc2CCCCCC)s1,ClCCl,364.0
CCCCCCc1ccsc1-c1ccc(-c2sc(C(=O)O)cc2CCCCCC)s1,O,365.0
CCCCCCc1ccsc1-c1ccc2c(c1)C1=[N+]3C2=Cc2c4ccc(-c5sccc5CCCCCC)cc4c4n2[B-]3(Oc2ccccc21)Oc1ccccc1-4,C1CCOC1,733.0
CCCCCCc1csc(-c2ccc(-c3cc(CCCCCC)c(/C=C/c4cc(-c5cc(CCCCCC)c(/C=C(\C#N)C(=O)O)s5)cc(/C=C/c5sc(-c6ccc(-c7cc(CCCCCC)cs7)c7nsnc67)cc5CCCCCC)c4OCC(CC)CCCC)s3)c3nsnc23)c1,ClC(Cl)Cl,492.0
CCCCCCc1csc(-c2sc(-c3sc(-c4sc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)c1,ClCCl,478.0
CCCCCCc1csc(-c2sc(-c3sc(-c4sc(-c5sc(-c6ccc(C=C(C#N)C(=O)O)s6)cc5CCCCCC)cc4CCCCCC)cc3CCCCCC)cc2CCCCCC)c1,ClCCl,486.0
CCCCCCc1csc(/C=C/c2sc(/C=C/c3sc(C=Cc4sc(/C=C(/C#N)C(=O)O)c(CCCCCC)c4CCCCCC)c(CCCCCC)c3CCCCCC)c(CCCCCC)c2CCCCCC)c1CCCCCC,ClCCl,557.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)sc1-c1ccc(C=C(C#N)C(=O)O)cc1,ClCCl,433.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)sc1-c1ccc(C=C(C#N)C(=O)O)o1,ClCCl,475.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)sc1-c1ccc(C=C(C#N)C(=O)O)s1,ClCCl,470.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,457.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)sc1C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,465.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(C=C(C#N)C(=O)O)s3)s2)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,457.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(N(c4ccc(/C=C(\C#N)C(=O)O)cc4)c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)s2)sc1-c1ccc(N(c2ccc(/C=C(\C#N)C(=O)O)cc2)c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,ClCCl,493.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)s2)sc1-c1ccc(/C=C(\C#N)C(=O)O)cc1,ClCCl,410.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)s2)sc1C#Cc1ccc(/C=C(\C#N)C(=O)O)cc1,ClCCl,426.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)sc1C=C(C#N)c1ccc(-c2ccc(C=C(C#N)C(=O)O)o2)cc1,ClCCl,480.0
CCCCCCc1nc(-c2nc(CCCCCC)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)sc1C=C(C#N)c1ccc(-c2ccc(C=C(C#N)C(=O)O)s2)cc1,ClCCl,471.0
CCCCCCc1nc2c(-c3ccc(/C=C(\C#N)C(=O)O)s3)c3nc(CCCCCC)c(CCCCCC)nc3c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c2nc1CCCCCC,ClCCl,584.0
CCCCCCc1nc2c(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c2nc1CCCCCC,ClCCl,510.0
CCCCCCc1nc2cc(C(=O)OC)ccn2c1NC1CCCCC1,CS(C)=O,368.0
CCCCCCc1sc(-c2ccc3c(c2)Sc2cc(-c4ccc(C=C(C#N)C(=O)O)s4)ccc2N3CCCCCC)c2c1OCCO2,ClCCl,490.0
CCCCCCc1sc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3CCCCCC)c2c1OCCO2,ClCCl,466.0
CCCCCCn1c(-c2ccc3c(c2)c2ccccc2n3CCCCCC)nc(-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2)c1-c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)cc1,C1CCOC1,398.0
CCCCCCn1c(-c2ccc3c(c2)c2ccccc2n3CCCCCC)nc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c1-c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,C1CCOC1,398.0
CCCCCCn1c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)ccc1/C=C(\C#N)C(=O)O,ClCCl,487.0
CCCCCCn1c(=CC2C(=O)C(=C[N+]3=C(CC)c4ccc(C(=O)O)cc4C3(C)C)C2O)c2cccc3cccc1c32,CCO,769.0
CCCCCCn1c(=CC2C(=O)C(=C[N+]3=C(CC)c4ccc(C(=O)O)cc4C3(CCCC)CCCC)C2O)c2cccc3cccc1c32,CCO,770.0
CCCCCCn1c(=O)c2c3[nH]c4cc5[nH]c6c(oc5cc4oc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O)c1c(=O)n(CCCCCC)c(=O)c1c1c(=O)n(CCCCCC)c(=O)c61,ClCCl,511.0
CCCCCCn1c(=O)c2c3[nH]c4cc5sc6c([nH]c5cc4sc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O)c1c(=O)n(CCCCCC)c(=O)c1c1c(=O)n(CCCCCC)c(=O)c61,ClCCl,549.0
CCCCCCn1c(=O)c2c3[nH]c4ccccc4[nH]c3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O,ClCCl,538.0
CCCCCCn1c(=O)c2c3[nH]c4ccccc4oc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O,ClCCl,454.0
CCCCCCn1c(=O)c2c3[nH]c4ccccc4sc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O,ClCCl,500.0
CCCCCCn1c(=O)c2c3nc4cc5sc6c(nc5cc4sc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O)c1c(=O)n(CCCCCC)c(=O)c1c1c(=O)n(CCCCCC)c(=O)c61,ClCCl,633.0
CCCCCCn1c(=O)c2c3nc4ccccc4nc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O,ClCCl,404.0
CCCCCCn1c(=O)c2c3oc4ccccc4oc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O,ClCCl,395.0
CCCCCCn1c(=O)c2c3sc4ccccc4sc3c3c(=O)n(CCCCCC)c(=O)c3c2c1=O,ClCCl,441.0
CCCCCCn1c(=S)n(CCCCCC)c2cc(N(c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)c3ccc4c(c3)n(CCCCCC)c(=S)n4CCCCCC)ccc21,CC#N,443.0
CCCCCCn1c(=S)n(CCCCCC)c2cc(N(c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)c3ccc4c(c3)n(CCCCCC)c(=S)n4CCCCCC)ccc21,ClCCl,506.0
CCCCCCn1c(=S)n(CCCCCC)c2cc(N(c3ccc(-c4sc(-c5cc(-c6ccc(CCCC)cc6)c(/C=C(\C#N)C(=O)O)s5)cc4-c4ccc(CCCC)cc4)cc3)c3ccc4c(c3)n(CCCCCC)c(=S)n4CCCCCC)ccc21,CC#N,463.0
CCCCCCn1c(C=C(C#N)c2ccc([N+](=O)[O-])cc2)ccc1/N=N\c1ccc(C(=O)O)cc1,C1CCOC1,625.0
CCCCCCn1c2c(c3cc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,416.0
CCCCCCn1c2c(c3cc(-c4ccc(/C=C(\C#N)C(=O)O)o4)ccc31)C(CC)(CC)c1ccccc1-2,ClCCl,472.0
CCCCCCn1c2c(c3cc(-c4ccc(/C=C(\C#N)C(=O)O)o4)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,470.0
CCCCCCn1c2c(c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,473.0
CCCCCCn1c2c(c3cc(-c4ccc(/C=C5\SC(=S)N(CC(=O)O)C5=O)cc4)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,460.0
CCCCCCn1c2c(c3cc(-c4ccc(/C=c5\sc(=C(C#N)C#N)[nH]c5=O)cc4)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,434.0
CCCCCCn1c2c(c3cc(-c4ccc(/C=c5\sc(=C(C#N)C#N)[nH]c5=O)s4)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,498.0
CCCCCCn1c2c(c3cc(-c4ccc5ccc6cccc7ccc4c5c67)ccc31)-c1c(c3cc(-c4ccc5ccc6cccc7ccc4c5c67)ccc3n1CCCCCC)-c1c(c3cc(-c4ccc5ccc6cccc7ccc4c5c67)ccc3n1CCCCCC)-c1c-2c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc2n1CCCCCC,ClCCl,340.0
CCCCCCn1c2c(c3cc(C#Cc4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,468.0
CCCCCCn1c2c(c3cc(C#Cc4ccc(/C=C(/C#N)C(=O)O)cc4)ccc31)C(CCCCCC)(CCCCCC)c1ccccc1-2,ClCCl,419.0
CCCCCCn1c2c(c3ccccc31)-c1c(c3ccccc3n1CCCCCC)-c1c(c3ccccc3n1CCCCCC)-c1c-2c2ccccc2n1CCCCCC,ClCCl,312.0
CCCCCCn1c2cc(-c3ccc(-n4c(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4/C=C(\C#N)C(=O)O)cc3)ccc2c2ccc(-c3ccc(-n4c(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4/C=C(\C#N)C(=O)O)cc3)cc21,ClCCl,425.0
CCCCCCn1c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2c2sc3c4sc(/C=C(\C#N)C(=O)O)cc4n(CCCCCC)c3c21,ClCCl,495.0
CCCCCCn1c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2c2sc3c4sc(C=C(C#N)C(=O)O)cc4n(CCCCCC)c3c21,ClCCl,495.0
CCCCCCn1c2cc(/C=C(/C#N)C(=O)O)sc2c2sc(-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(-c5cc6c(s5)c5sc(/C=C(\C#N)C(=O)O)cc5n6CCCCCC)ccc3-4)cc21,C1CCOC1,520.0
CCCCCCn1c2cc(/C=C(\C#N)C(=O)O)sc2c2c3nn(CC(CC)CCCC)nc3c3c4sc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4n(CCCCCC)c3c21,C1CCOC1,480.0
CCCCCCn1c2cc(/C=C(\C#N)C(=O)O)sc2c2sc(-c3ccc(N(c4ccc(-n5c6ccsc6c6sccc65)cc4)c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4c6c(c7c(c4-5)C(CCCCCC)(CCCCCC)c4ccccc4-7)C(CCCCCC)(CCCCCC)c4ccccc4-6)cc3)cc21,ClCCl,510.0
CCCCCCn1c2cc(/C=C(\C#N)C(=O)O)sc2c2sc(-c3ccc(N(c4ccc(N(c5ccc6c(c5)-c5ccccc5C6(CCC)CCC)c5ccc6c(c5)-c5ccccc5C6(CCC)CCC)cc4)c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4c6c(c7c(c4-5)C(CCCCCC)(CCCCCC)c4ccccc4-7)C(CCCCCC)(CCCCCC)c4ccccc4-6)cc3)cc21,ClCCl,529.0
CCCCCCn1c2cc(/C=C(\C#N)C(=O)O)sc2c2sc(-c3ccc(N(c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4c6c(c7c(c4-5)C(CCCCCC)(CCCCCC)c4ccccc4-7)C(CCCCCC)(CCCCCC)c4ccccc4-6)cc3)cc21,CN(C)C=O,531.0
CCCCCCn1c2cc(/C=C(\C#N)C(=O)O)sc2c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,484.0
CCCCCCn1c2cc(/C=C(\C#N)C(=O)O)sc2c2sc(-c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3cc(-c5cc6c(s5)c5sc(/C=C(\C#N)C(=O)O)cc5n6CCCCCC)ccc3-4)cc21,C1CCOC1,520.0
CCCCCCn1c2cc(/C=C(\C#N)c3ccccc3)ccc2c2ccc(/C=C(\C#N)c3ccccc3)cc21,ClC(Cl)Cl,423.7288136
CCCCCCn1c2cc(/C=C(\C#N)c3cccs3)ccc2c2ccc(/C=C(\C#N)c3cccs3)cc21,ClC(Cl)Cl,436.6812227
CCCCCCn1c2cc(/C=C/c3ccccc3)ccc2c2ccc(/C=C/c3ccccc3)cc21,ClC(Cl)Cl,390.625
CCCCCCn1c2cc(/C=C/c3cccs3)ccc2c2ccc(/C=C/c3cccs3)cc21,ClC(Cl)Cl,408.1632653
CCCCCCn1c2cc(C=C(C#N)C(=O)O)ccc2c2ccc(-c3ccc(-c4ccc(N(c5ccc(C(C)(C)C)cc5)c5ccc(C(C)(C)C)cc5)cc4)c4nsnc34)cc21,ClCCl,460.0
CCCCCCn1c2cc(C=C(C#N)C(=O)O)ccc2c2ccc(-c3ccc(N(c4ccc(C(C)(C)C)cc4)c4ccc(C(C)(C)C)cc4)cc3)cc21,ClCCl,438.0
CCCCCCn1c2cc(C=C(C#N)C(=O)O)ccc2c2ccc(-c3ccc4c(c3)c3cc(C(C)(C)C)ccc3n4-c3ccc(C(C)(C)C)cc3)cc21,ClCCl,423.0
CCCCCCn1c2cc(C=C(C#N)C(=O)O)sc2c2sc(-c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc21,ClCCl,502.0
CCCCCCn1c2cc(C=O)sc2c2sc3c(sc4c5sc(C=O)cc5n(CCCCCC)c43)c21,ClCCl,468.0
CCCCCCn1c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)s3)cc2c2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)ccc21,C1CCOC1,468.0
CCCCCCn1c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc2c2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)ccc21,C1CCOC1,468.0
CCCCCCn1c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)cc2c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc21,C1CCOC1,470.0
CCCCCCn1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)n3C)cc2c2cc(N(c3ccccc3)c3ccccc3)ccc21,C1CCOC1,497.0
CCCCCCn1c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)o3)cc2c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,C1CCOC1,442.0
CCCCCCn1c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,C1CCOC1,422.0
CCCCCCn1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)ccc21,CN(C)C=O,362.0
CCCCCCn1c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)cc2c2cc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)ccc21,CN(C)C=O,362.0
CCCCCCn1c2ccc(-c3ccc(C=C(C#N)C(=O)O)o3)cc2c2cc(-c3ccc(/C=C(/C#N)C(=O)O)o3)ccc21,CN(C)C=O,427.0
CCCCCCn1c2ccc(-c3ccc(C=C(C#N)C(=O)O)o3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,CN(C)C=O,427.0
CCCCCCn1c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2c2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,CN(C)C=O,415.0
CCCCCCn1c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,CN(C)C=O,415.0
CCCCCCn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,ClCCl,468.0
CCCCCCn1c2ccc(/C=C(/C#N)C(=O)O)cc2c2cc(-c3ccc4c(c3)c3cc(/C=C(/C#N)C(=O)O)ccc3n4CCCCCC)ccc21,C1CCOC1,402.0
CCCCCCn1c2ccc(/C=C(/C#N)C(=O)OCC)cc2c2cc(-c3ccc4c(c3)c3cc(/C=C(/C#N)C(=O)OCC)ccc3n4CCCCCC)ccc21,C1CCOC1,408.0
CCCCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2cc(-c3ccc(C=C(c4ccc(N5c6ccccc6Sc6ccccc65)cc4)c4ccc(N5c6ccccc6Sc6ccccc65)cc4)cc3)ccc21,ClCCl,412.0
CCCCCCn1c2ccc(/C=C(\C#N)c3ccc(C=C(C(=O)O)C(=O)O)s3)cc2c2cc(/C=C(\C#N)c3ccc(C=C(C(=O)O)C(=O)O)s3)ccc21,CN(C)C=O,537.0
CCCCCCn1c2ccc(/C=C3\SC(=O)NC3=O)cc2c2cc(-c3ccc(OC)cc3)ccc21,ClC(Cl)Cl,385.0
CCCCCCn1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2c2cc(-c3ccc4c(c3)c3cc(/C=C5/SC(=S)N(CC(=O)O)C5=O)ccc3n4CCCCCC)ccc21,C1CCOC1,449.0
CCCCCCn1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2c2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc21,CN(C)C=O,450.0
CCCCCCn1c2ccc(C(Cl)=CC=Nc3ccc(C(=O)O)c(O)c3)cc2c2cc(C(Cl)=CC=Nc3ccc(C(=O)O)c(O)c3)ccc21,CN(C)C=O,423.0
CCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2cc(-c3ccc(C=C(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)ccc21,ClCCl,412.0
CCCCCCn1c2ccc(C=C(C#N)C(=O)O)cc2c2cc(-c3ccc(C=C(c4ccc(N5c6ccccc6Sc6ccccc65)cc4)c4ccc(N5c6ccccc6Sc6ccccc65)cc4)cc3)ccc21,ClCCl,412.0
CCCCCCn1c2ccc(C=C(C#N)c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)cc4)cc3)cc2c2cc(/C=C(\C#N)c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)cc4)cc3)ccc21,CN(C)C=O,419.0
CCCCCCn1c2ccc(C=C3C(=O)NC(=O)NC3=O)cc2c2cc(-c3ccc(OC)cc3)ccc21,ClC(Cl)Cl,457.0
CCCCCCn1c2ccc(C=C3C(=O)NC(=O)NC3=O)cc2c2cc(C=C3C(=O)NC(=O)NC3=O)ccc21,C1CCOC1,455.0
CCCCCCn1c2ccc(C=C3C(=O)NC(=S)NC3=O)cc2c2cc(C=C3C(=O)NC(=S)NC3=O)ccc21,C1CCOC1,457.0
CCCCCCn1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2c2cc(C=C3SC(=S)N(CC(=O)O)C3=O)ccc21,CN(C)C=O,450.0
CCCCCCn1c2ccccc2c2c(-c3ccccc3)c3c(c(-c4ccccc4)c21)c1cc(-c2ccc(-c4cc5sc(/C=C(\C#N)C(=O)O)cc5s4)c4nsnc24)ccc1n3CCCCCC,C1CCOC1,522.0
CCCCCCn1c2ccccc2c2c(-c3ccccc3)c3c(c(-c4ccccc4)c21)c1cc(-c2ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)c4nsnc24)ccc1n3CCCCCC,C1CCOC1,522.0
CCCCCCn1c2ccccc2c2c(-c3ccccc3)c3c(c(-c4ccccc4)c21)c1cc(-c2ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s2)ccc1n3CCCCCC,C1CCOC1,453.0
CCCCCCn1c2ccccc2c2cc(-c3c(/C=C(\C#N)C(=O)O)sc(/C=C(\C#N)C(=O)O)c3-c3ccc4c(c3)c3ccccc3n4CCCCCC)ccc21,ClC(Cl)Cl,393.0
CCCCCCn1c2ccccc2c2cc(-c3cc(-c4sc(C=C(C#N)C(=O)O)cc4-c4ccc5c(c4)c4ccccc4n5CCCCCC)sc3-c3ccc4c(c3)c3ccccc3n4CCCCCC)ccc21,ClCCl,400.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-c4cc(-c5ccccn5)nc(-c5ccccn5)c4)cc3)ccc21,ClCCl,296.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc21,C1CCOC1,461.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-n4c(/C=C(/C#N)C(=O)O)ccc4/C=C/c4cc5cc(-c6ccc7c(c6)c6ccccc6n7CCCCCC)ccc5n4CCCC)cc3)ccc21,CCO,470.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-n4c(/C=C(/C#N)C(=O)O)ccc4/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)ccc21,C1CCOC1,415.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-n4c(/C=C(/C#N)C(=O)O)ccc4/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)ccc21,CCO,415.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-n4c(/C=C(/C#N)C(=O)O)ccc4/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)ccc21,CN(C)C=O,415.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-n4c(/C=C(/C#N)C(=O)O)ccc4/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)ccc21,ClCCl,415.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(-n4c(/C=C/c5cc6cc(-c7ccc8c(c7)c7ccccc7n8CCCCCC)ccc6n5CCCC)ccc4/C=C(\C#N)C(=O)O)cc3)ccc21,CCO,470.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)ccc21,ClC(Cl)Cl,412.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)cc3)ccc21,ClC(Cl)Cl,438.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(C=C(C#N)C(=O)O)c(F)c3F)ccc21,ClC(Cl)Cl,402.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(C=C(C#N)C(=O)O)cc3)ccc21,ClC(Cl)Cl,380.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(C=C(C#N)C(=O)O)cc3F)ccc21,ClC(Cl)Cl,400.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(C=C4C(=O)NC(=O)NC4=O)cc3)ccc21,ClC(Cl)Cl,458.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(C=C4C(=O)NC(=S)NC4=O)cc3)ccc21,ClC(Cl)Cl,489.0
CCCCCCn1c2ccccc2c2cc(-c3ccc(N(c4ccc(-c5cc6c(s5)-c5sc(/C=C(\C#N)C(=O)O)cc5C6(CCCCCC)CCCCCC)cc4)c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4c6c(c7c(c4-5)C(CCCCCC)(CCCCCC)c4ccccc4-7)C(CCCCCC)(CCCCCC)c4ccccc4-6)cc3)ccc21,ClCCl,551.0
CCCCCCn1c2ccccc2c2cc(-c3ccc4c(c3)c3nc5cc(-c6ccc(/C=C(\C#N)C(=O)O)s6)ccc5nc3n4CC)ccc21,CN(C)C=O,416.0
CCCCCCn1c2ccccc2c2cc(-c3nc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)c(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)[nH]3)ccc21,C1CCOC1,388.0
CCCCCCn1c2ccccc2c2cc(-n3cc(/C=C(\C#N)C(=O)O)c4ccccc43)ccc21,CCO,389.0
CCCCCCn1c2ccccc2c2cc(/C=C(/C#N)c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClC(Cl)Cl,488.0
CCCCCCn1c2ccccc2c2cc(/C=C(/C#N)c3ccc(C=C4C(=O)NC(=O)NC4=O)s3)ccc21,ClC(Cl)Cl,524.0
CCCCCCn1c2ccccc2c2cc(/C=C/c3cc(=O)oc4cc(C)ccc34)ccc21,CS(C)=O,405.0
CCCCCCn1c2ccccc2c2cc(/C=C/c3cc(=O)oc4cc(C)ccc34)ccc21,ClC(Cl)Cl,393.0
CCCCCCn1c2ccccc2c2cc(/C=C/c3ccc(C=C(C#N)C(=O)O)cc3)ccc21,CCO,435.0
CCCCCCn1c2ccccc2c2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc21,CC#N,438.0
CCCCCCn1c2ccccc2c2cc(C#Cc3ccc(N(c4ccc(C#Cc5ccc6c(c5)c5ccccc5n6CCCCCC)cc4)c4ccc(C=C(C#N)C(=O)O)cc4)cc3)ccc21,ClCCl,438.0
CCCCCCn1c2ccccc2c2cc(C(Cl)=CC=Nc3ccc(C(=O)O)c(O)c3)ccc21,CN(C)C=O,413.0
CCCCCCn1c2ccccc2c2cc(C(c3ccc(-c4cc5c(s4)-c4sc(/C=C(\C#N)C(=O)O)cc4C5(CCCCCC)CCCCCC)cc3)c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3c5c(c6c(c3-4)C(CCCCCC)(CCCCCC)c3ccccc3-6)C(CCCCCC)(CCCCCC)c3ccccc3-5)ccc21,ClCCl,551.0
CCCCCCn1c2ccccc2c2cc(C=C3C(=O)NC(=O)NC3=O)ccc21,C1CCOC1,427.0
CCCCCCn1c2ccccc2c2cc(N(c3ccc(-c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4c6c(c7c(c4-5)C(CCCCCC)(CCCCCC)c4ccccc4-7)C(CCCCCC)(CCCCCC)c4ccccc4-6)cc3)c3ccc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5CCCCCC)c(C(=O)OC)c3)ccc21,ClCCl,493.0
CCCCCCn1c2ccccc2c2cc(N(c3ccc(-c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4c6c(c7c(c4-5)C(CCCCCC)(CCCCCC)c4ccccc4-7)C(CCCCCC)(CCCCCC)c4ccccc4-6)cc3)c3ccc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5CCCCCC)cc3)ccc21,ClCCl,536.0
CCCCCCn1c2ccccc2c2cc(N3c4ccc(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)c6nsnc56)cc4C4CCCC43)ccc21,ClCCl,554.0
CCCCCCn1c2ccccc2c2cc(N3c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)c6nsnc56)cc4[C@@H]4CCC[C@@H]43)ccc21,ClCCl,554.0
CCCCCCn1c2ccccc2c2cc(N3c4ccc(/C=C(\C#N)C(=O)O)cc4Sc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc43)ccc21,ClCCl,491.0
CCCCCCn1c2ccccc2c2cc(N3c4ccccc4Sc4cc(/C=C5\SC(=S)N(CC(=O)O)C5=O)ccc43)ccc21,ClCCl,500.0
CCCCCCn1c2ccccc2c2ccc(-c3cc(-c4ccc(/C=C(/C#N)C(=O)O)s4)c(-c4ccc(C=C(C#N)C(=O)O)s4)s3)cc21,C1CCOC1,482.0
CCCCCCn1c2ccccc2c2ccc(N(c3ccc(-c4cc5c(s4)c4sc(C=C(C#N)C(=O)O)cc4n5CCCCCC)cc3)c3ccc4c(c3)C(CCCCCC)(CCCCCC)c3c5c(c6c(c3-4)C(CCCCCC)(CCCCCC)c3ccccc3-6)C(CCCCCC)(CCCCCC)c3ccccc3-5)cc21,ClCCl,538.0
CCCCCCn1c2ccccc2c2ccc(N3c4ccccc4Sc4cc(/C=C(\C#N)C(=O)O)ccc43)cc21,ClCCl,481.0
CCCCCCn1c2ccccc2c2sc3c4sc(/C=C(\C#N)C(=O)O)cc4n(CCCCCC)c3c21,ClCCl,503.0
CCCCCCn1c2ccccc2c2sc3c4sc(C=C(C#N)C(=O)O)cc4n(CCCCCC)c3c21,ClCCl,503.0
CCCCCCn1c2ccsc2c2sc(-c3ccc(N(c4ccc(-c5cc6c(s5)c5sc(/C=C(\C#N)C(=O)O)cc5n6CCCCCC)cc4)c4ccc5c(c4)C(CCCCCC)(CCCCCC)c4c6c(c7c(c4-5)C(CCCCCC)(CCCCCC)c4ccccc4-7)C(CCCCCC)(CCCCCC)c4ccccc4-6)cc3)cc21,ClCCl,521.0
CCCCCCn1c2ccsc2c2sc3c(sc4c5sccc5n(CCCCCC)c43)c21,ClCCl,380.0
CCCCCCn1cc(/C=C(/C#N)C(=O)O)c2cc(-c3ccc(N(c4cc#ccc4)c4ccccc4)cc3)ccc21,ClC(Cl)Cl,404.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)s2)c2cc(OC)ccc21,ClC(Cl)Cl,517.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)s2)c2cc([N+](=O)[O-])ccc21,ClC(Cl)Cl,497.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)s2)c2ccccc21,ClC(Cl)Cl,511.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(/C=N/c3ccc(C(=O)O)cc3)s2)c2cc(OC)ccc21,ClC(Cl)Cl,462.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(/C=N/c3ccc(C(=O)O)cc3)s2)c2cc([N+](=O)[O-])ccc21,ClC(Cl)Cl,451.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(/C=N/c3ccc(C(=O)O)cc3)s2)c2ccccc21,ClC(Cl)Cl,452.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(C=C(C#N)C(=O)O)s2)c2cc(OC)ccc21,ClC(Cl)Cl,503.0
CCCCCCn1cc(/C=C(/C#N)c2ccc(C=C(C#N)C(=O)O)s2)c2ccccc21,ClC(Cl)Cl,495.0
CCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,C1COCCO1,391.0
CCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CC#N,389.0
CCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CCO,396.0
CCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,CS(C)=O,402.0
CCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,Cc1ccccc1,394.0
CCCCCCn1cc(C(=O)c2ccc3c(c2)C(C)(C)c2cc(N(C)C)ccc2-3)nn1,ClC(Cl)Cl,399.0
CCCCCCn1cc(C=C(C#N)c2ccc(C=C(C#N)C(=O)O)s2)c2cc([N+](=O)[O-])ccc21,ClC(Cl)Cl,460.0
CCCCCCn1cc(C=C2C(=O)NC(=O)NC2=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,ClC(Cl)Cl,440.0
CCCCCCn1nc2c(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c2n1,C1CCOC1,462.0
CCCCCCn1nc2c(-c3ccc(C=C(C#N)C(=O)O)cc3)cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2n1,C1CCOC1,440.0
CCCCCCn1nc2c(-c3ccc(C=C(C#N)C(=O)O)o3)cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2n1,C1CCOC1,476.0
CCCCCCn1nc2c(-c3ccc(C=C(C#N)C(=O)O)s3)cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2n1,C1CCOC1,482.0
CCCCCCn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cnc(-c3ccc(C=C(C#N)C(=O)O)o3)c2n1,C1CCOC1,464.0
CCCCCCn1nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cnc(-c3ccc(C=C(C#N)C(=O)O)s3)c2n1,C1CCOC1,472.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,C1CCOC1,456.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,C1COCCO1,464.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CC#N,430.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CC(C)=O,464.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CCOC(C)=O,460.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CN(C)C=O,418.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CS(C)=O,430.0
CCCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,ClCCl,470.0
CCCCCN1/C(=C\C=C2/SC(=S)N(CC(=O)O)C2=O)Sc2ccccc21,CCO,520.0
CCCCCN1c2ccccc2Oc2cc(/C=C/c3cc(OCC)c(/C=C(/C#N)C(=O)O)cc3OCC)ccc21,ClCCl,509.0
CCCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,494.0
CCCCCNC(=O)COc1ccc(/C=C/c2ccc3n2[B-](F)(F)[N+]2=C(c4cccs4)C=CC2=C3)cc1,CO,625.0
CCCCCOc1cc2oc(=O)c3c4ccc(C#N)cc4c4ccc5cccc6c(c1)c2c3c4c56,C1CCOC1,426.0
CCCCCOc1cc2oc(=O)c3c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4c4ccc5cccc6c(c1)c2c3c4c56,C1CCOC1,487.0
CCCCCOc1cc2oc(=O)c3c4ccc(N(c5ccccc5)c5ccccc5)cc4c4ccc5cccc6c(c1)c2c3c4c56,C1CCOC1,476.0
CCCCCOc1cc2oc(=O)c3c4ccc(O)cc4c4ccc5cccc6c(c1)c2c3c4c56,C1CCOC1,443.0
CCCCCOc1cc2oc(=O)c3c4occc4c4ccc5cccc6c(c1)c2c3c4c56,C1CCOC1,422.0
CCCCCOc1ccc2c(c1)c1ccc3cccc4c5cc(OC)cc6oc(=O)c2c(c65)c1c34,C1CCOC1,440.0
CCCCCOc1ccc2c(c1)c1ccc3cccc4c5cccc6oc(=O)c2c(c65)c1c34,C1CCOC1,426.0
CCCCC[C@@H](CC)n1c2ccc(OC)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)c3ccccc3c21,ClCCl,462.0
CCCCC[C@@H](CC)n1c2ccc(OC)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c3ccccc3c21,ClCCl,458.0
CCCCC[C@H](CC)N1c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2Oc2cc(N(c3ccccc3)c3ccccc3)ccc21,C1CCOC1,483.0
CCCCC[C@H](CC)N1c2ccc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)cc2Oc2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,C1CCOC1,476.0
CCCCC[C@H](CC)N1c2ccc(-c3ccc(N4c5ccccc5Sc5ccccc54)cc3)cc2Oc2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,C1CCOC1,475.0
CCCCC[C@H](CC)N1c2ccccc2Oc2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,C1CCOC1,465.0
CCCCC[Si]1(CCCCC)c2cc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)ccc2-c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C)cc3)cc21,CN(C)C=O,386.0
CCCCC[Si]1(CCCCC)c2cc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)ccc2-c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(OC)cc3)cc21,CN(C)C=O,390.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,C1CCOC1,502.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,C1COCCO1,495.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,CC#N,496.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,CC(C)=O,503.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,CCCCO,522.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,CCO,508.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,CN(C)C=O,501.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,CO,503.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,CS(C)=O,506.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,ClC(Cl)Cl,522.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,O,452.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,c1ccccc1,494.0
CCCCC[n+]1ccc(/C=C/c2ccc(N(C)C)c3ccccc23)c2ccccc21,c1ccncc1,526.0
CCCCCc1c(-c2ccccc2)c(-c2ccc(/C=C(\C#N)C(=O)O)s2)n2ccc(OC)cc12,ClCCl,675.0
CCCCCc1c(/C=C(\C#N)C(=O)O)sc2c1sc1c3sc4c(CCCCC)c(-c5ccc(-c6ccc7c(c6)c6ccccc6n7CC(CC)CCCC)c6nsnc56)sc4c3c3nc4ccccc4nc3c21,C1CCOC1,589.0
CCCCCc1c(/C=C(\C#N)C(=O)O)sc2c1sc1c3sc4c(CCCCC)c(-c5ccc(-c6ccc7c(c6)c6ccccc6n7CC(CC)CCCC)c6nsnc56)sc4c3c3nccnc3c21,C1CCOC1,603.0
CCCCCc1c(/C=C(\C#N)C(=O)O)sc2c1sc1c3sc4c(CCCCC)c(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)sc4c3c3nc4ccccc4nc3c21,C1CCOC1,545.0
CCCCCc1c(/C=C(\C#N)C(=O)O)sc2c1sc1c3sc4c(CCCCC)c(-c5ccc6c(c5)c5ccccc5n6CC(CC)CCCC)sc4c3c3nccnc3c21,C1CCOC1,543.0
CCCCCc1c(C(=O)c2ccc3c4c(cccc24)-c2cccc4c2C3CC=C4)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,470.0
CCCCCc1c(Oc2cc(O)cc(CCC(=O)CC)c2C(=O)OC)c(OC)cc(O)c1C(=O)O,ClC(Cl)Cl,312.0
CCCCCc1ccc(-c2ccc(C#Cc3cc(C#Cc4ccc(-c5ccc(CCCCC)cc5)cc4)c4ccc5c(C(=O)c6ccccc6)cc(C#Cc6ccc(-c7ccc(CCCCC)cc7)cc6)c6ccc3c4c65)cc2)cc1,ClCCl,466.0
CCCCCc1ccc(C#Cc2cc(C#Cc3ccc(CCCCC)cc3)c3ccc4c(C(=O)c5ccccc5)cc(C#Cc5ccc(CCCCC)cc5)c5ccc2c3c54)cc1,ClCCl,457.0
CCCCCc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,429.0
CCCCCc1ccc(N(c2ccc(CCCCC)cc2)c2ccc3c(c2)/C=N/c2ccc(C(=O)O)cc2/N=C/c2cc(N(c4ccc(CCCCC)cc4)c4ccc(CCCCC)cc4)ccc2O[Zn]O3)cc1,C1CCOC1,452.0
CCCCCc1nc2c(-c3ccc4c(c3)[C@H]3CCC[C@H]3N4c3ccc(C)cc3)ccc(-c3cc4c5nc(CCCCC)c(CCCCC)nc5c5cc(/C=C(\C#N)C(=O)O)sc5c4s3)c2nc1CCCCC,ClC(Cl)Cl,511.0
CCCCCc1nc2c(-c3ccc4c(c3)[C@H]3CCC[C@H]3N4c3ccc(C)cc3)cnc(-c3cc4c5nc(CCCCC)c(CCCCC)nc5c5cc(/C=C(\C#N)C(=O)O)sc5c4s3)c2nc1CCCCC,ClC(Cl)Cl,502.0
CCCCCc1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(-c5ccc6c(c5)C5CCCC5N6c5ccc(C)cc5)c5nsnc45)cc3c2nc1CCCCC,ClC(Cl)Cl,547.0
CCCCCc1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(-c5ccc6c(c5)[C@@H]5CCC[C@@H]5N6c5ccc(C)cc5)c5nsnc45)cc3c2nc1CCCCC,ClC(Cl)Cl,547.0
CCCCCc1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c2nc1CCCCC,ClC(Cl)Cl,496.0
CCCCCc1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc5c(c4)[C@H]4CCC[C@H]4N5c4ccc(C)cc4)cc3c2nc1CCCCC,ClC(Cl)Cl,498.0
CCCCCn1c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,Cc1ccccc1,411.0
CCCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2cc(/C=C(\C#N)c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,CN(C)C=O,397.0
CCCCCn1c2ccc(/C=C/C(=O)O)cc2c2cc(/C=C(\C#N)c3ccc(/C=C/C(=O)O)s3)ccc21,CN(C)C=O,392.0
CCCCCn1c2ccc(/C=N\c3ccc(C(=O)O)cc3)cc2c2cc(/C=C(\C#N)c3ccc(/C=N/c4ccc(C(=O)O)cc4)s3)ccc21,CN(C)C=O,426.0
CCCCCn1c2ccc(S(=O)(=O)Cl)cc2c(=O)c2cc(S(=O)(=O)Cl)ccc21,CS(C)=O,406.0
CCCCCn1c2ccc(S(=O)(=O)O)cc2c(=O)c2cc(S(=O)(=O)O)ccc21,CS(C)=O,406.0
CCCCCn1c2ccc(S(=O)(=O)O)cc2c(=O)c2cc(S(=O)(=O)O)ccc21,O,406.0
CCCCCn1c2ccccc2c2cc(N3c4ccc(-c5ccc(/C=C6/SC(=S)N(CC(=O)O)C6=O)s5)cc4[C@H]4CCC[C@H]43)ccc21,CO,518.0
CCCCN(CCCC)c1cc(OC)c(/C=C/c2ccc(/C=C/c3ccnc(-c4cc(C)ccn4)c3)cc2)cc1OC,ClCCl,412.0
CCCCN(CCCC)c1ccc(-c2ccc(/C=C/C(C#N)C(=O)O)s2)s1,CC#N,478.0
CCCCN(CCCC)c1ccc(-c2ccc(/C=C/c3ccc(C(=O)[O-])c[n+]3C)s2)s1,CC#N,555.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc(-c3ccc(/C=C/c4ccc(N(CCCC)CCCC)cc4)cc3)cc2)cc1,CS(C)=O,412.9
CCCCN(CCCC)c1ccc(/C=C/c2ccc(-c3ccc(/C=C/c4ccc(N(CCCC)CCCC)cc4)cc3)cc2)cc1,Cc1ccccc1,399.3
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(-c4ccccc4)c(/C=C/c4ccc(N(C)C)cc4)nc3c2)cc1,C1COCCO1,458.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(-c4ccccc4)c(/C=C/c4ccc(N(C)C)cc4)nc3c2)cc1,CC#N,462.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(-c4ccccc4)c(/C=C/c4ccc(N(C)C)cc4)nc3c2)cc1,ClCCl,468.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4ccc(N(C)C)cc4)c(-c4ccccc4)nc3c2)cc1,C1COCCO1,475.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4ccc(N(C)C)cc4)c(-c4ccccc4)nc3c2)cc1,CC#N,487.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4ccc(N(C)C)cc4)c(-c4ccccc4)nc3c2)cc1,ClCCl,482.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4ccc(N(C)C)cc4)c(=O)n(CCC)c3c2)cc1,C1COCCO1,481.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4ccc(N(C)C)cc4)c(=O)n(CCC)c3c2)cc1,CC#N,488.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4ccc(N(C)C)cc4)c(=O)n(CCC)c3c2)cc1,ClCCl,494.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4nc5ccc(/C=C/c6ccc(N(CCCC)CCCC)cc6)cc5n(CCC)c4=O)c(=O)n(CCC)c3c2)cc1,C1COCCO1,528.0
CCCCN(CCCC)c1ccc(/C=C/c2ccc3nc(/C=C/c4nc5ccc(/C=C/c6ccc(N(CCCC)CCCC)cc6)cc5n(CCC)c4=O)c(=O)n(CCC)c3c2)cc1,ClCCl,549.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3c(F)c(F)c(F)c(F)c3F)c(C#Cc3c(F)c(F)c(F)c(F)c3F)cc2C#Cc2ccc(N(CCCC)CCCC)cc2)cc1,ClCCl,423.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3c(F)c(F)c(F)c(F)c3F)c(C#Cc3ccc(N(CCCC)CCCC)cc3)cc2C#Cc2c(F)c(F)c(F)c(F)c2F)cc1,ClCCl,462.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc(C#N)cc3)c(C#Cc3ccc(C#N)cc3)cc2C#Cc2ccc(N(CCCC)CCCC)cc2)cc1,ClCCl,416.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc(C#N)cc3)c(C#Cc3ccc(N(CCCC)CCCC)cc3)cc2C#Cc2ccc(C#N)cc2)cc1,ClCCl,454.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc(C(F)(F)F)cc3)c(C#Cc3ccc(C(F)(F)F)cc3)cc2C#Cc2ccc(N(CCCC)CCCC)cc2)cc1,ClCCl,407.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc(N(CCCC)CCCC)cc3)c(C#Cc3c(F)c(F)c(F)c(F)c3F)cc2C#Cc2c(F)c(F)c(F)c(F)c2F)cc1,ClCCl,438.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc(N(CCCC)CCCC)cc3)c(C#Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2C#Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1,ClCCl,433.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc(N(CCCC)CCCC)cc3)c(C#Cc3ccc(C(F)(F)F)cc3)cc2C#Cc2ccc(C(F)(F)F)cc2)cc1,ClCCl,427.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc([N+](=O)[O-])cc3)c(C#Cc3ccc(N(CCCC)CCCC)cc3)cc2C#Cc2ccc([N+](=O)[O-])cc2)cc1,ClCCl,448.0
CCCCN(CCCC)c1ccc(C#Cc2cc(C#Cc3ccc([N+](=O)[O-])cc3)c(C#Cc3ccc([N+](=O)[O-])cc3)cc2C#Cc2ccc(N(CCCC)CCCC)cc2)cc1,ClCCl,417.0
CCCCN(CCCC)c1ccc([C+]2C([O-])[C+](c3ccc(/C=C4/N(CCOC(=O)CCC(=O)Oc5ccc6c(=C(C#N)C#N)c7cc(O)ccc7c(=C(C#N)C#N)c6c5)c5ccccc5C4(C)C)cc3)C2[O-])cc1,ClC(Cl)Cl,637.0
CCCCN(CCCC)c1ccc([C+]2C([O-])[C+](c3ccc(N(C)CCOC(=O)CCC(=O)Oc4ccc5c(=C(C#N)C#N)c6cc(O)ccc6c(=C(C#N)C#N)c5c4)cc3)C2[O-])cc1,ClC(Cl)Cl,633.0
CCCCN(CCCC)c1ccc([C+]2C([O-])[C+](c3ccc(N(C)CCOC(=O)CCc4cc(=C(C#N)C#N)ccc4=C(C#N)C#N)cc3)C2[O-])cc1,ClC(Cl)Cl,633.0
CCCCN(CCCC)c1ccc2c#cc3cc4c#cc5ccc(C(F)(F)F)cc5c#cc#cc5cc(C(F)(F)F)ccc5c#cc4cc3c#cc3ccc(N(CCCC)CCCC)cc3c#cc#cc2c1,ClCCl,450.0
CCCCN(CCCC)c1ccc2c#cc3cc4c#cc5ccc(C(F)(F)F)cc5c#cc#cc5cc(N(CCCC)CCCC)ccc5c#cc4cc3c#cc3ccc(C(F)(F)F)cc3c#cc#cc2c1,ClCCl,472.0
CCCCN(CCCC)c1ccc2c#cc3cc4c#cc5ccc(N(CCCC)CCCC)cc5c#cc#cc5cc(C(F)(F)F)ccc5c#cc4cc3c#cc3ccc(C(F)(F)F)cc3c#cc#cc2c1,ClCCl,454.0
CCCCN(CCCC)c1ccc2c(-c3cc(C)c(OC)c(C)c3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3cc(C)cc(C)c3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3ccc(C(C)(C)C)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCCCN(CCCC)c1ccc2c(-c3ccc(C)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3ccc(CCC)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCCCN(CCCC)c1ccc2c(-c3ccc(CN4CCCCC4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,540.0
CCCCN(CCCC)c1ccc2c(-c3ccc(F)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,540.0
CCCCN(CCCC)c1ccc2c(-c3ccc(N(C)C)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCCCN(CCCC)c1ccc2c(-c3ccc(OC)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3ccc(Oc4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3ccc(SC)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3ccc4cc(OC)ccc4c3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3ccc4ccccc4c3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(-c3cccc(CN4CCCCC4)c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCCCN(CCCC)c1ccc2c(-c3cccc(F)c3)c3ccc(=[NH2+])cc-3oc2c1,O,540.0
CCCCN(CCCC)c1ccc2c(-c3ccccc3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCCCN(CCCC)c1ccc2c(c1)C#CC#Cc1cc(C(F)(F)F)ccc1C#Cc1cc(c3cc1C#Cc1ccc(C(F)(F)F)cc1C#CC#Cc1cc(N(CCCC)CCCC)ccc1C#C3)C#C2,ClCCl,474.0
CCCCN(CCCC)c1ccc2c(c1)C#CC#Cc1cc(C(F)(F)F)ccc1C#Cc1cc(c3cc1C#Cc1ccc(N(CCCC)CCCC)cc1C#CC#Cc1cc(C(F)(F)F)ccc1C#C3)C#C2,ClCCl,477.0
CCCCN(CCCC)c1ccc2c(c1)C#CC#Cc1cc(N(CCCC)CCCC)ccc1C#Cc1cc(c3cc1C#Cc1ccc(C(F)(F)F)cc1C#CC#Cc1cc(C(F)(F)F)ccc1C#C3)C#C2,ClCCl,466.0
CCCCN(CCCC)c1ccc2c(c1)OC1=NC(c3ccc(O)c(C(=O)O)c3)n3c(nc4ccccc43)C1=C2,CS(C)=O,450.0
CCCCN(CCCC)c1ccc2c(c1)oc1c3oc(-c4ccc(C#N)cc4)nc3c3c(c4ccccc4n3CCCC(=O)O)c21,C1COCCO1,425.0
CCCCN(CCCC)c1ccc2c(c1)oc1c3oc(-c4ccc(C#N)cc4)nc3c3c(c4ccccc4n3CCCCCC(=O)O)c21,C1COCCO1,431.0
CCCCN(CCCC)c1ccc2c(c1)oc1c3oc(-c4ccc(C(=O)O)cc4)nc3c3[nH]c4ccccc4c3c21,C1CCOC1,412.0
CCCCN(CCCC)c1ccc2c(c1)oc1c3oc(-c4ccc(C(=O)O)cc4)nc3c3[nH]c4ccccc4c3c21,C1COCCO1,416.0
CCCCN(CCCC)c1ccc2c(c1)oc1c3oc(-c4ccc(C(=O)O)cc4)nc3c3c(c4ccccc4n3CCCCCC(=O)O)c21,C1COCCO1,417.0
CCCCN(CCCC)c1ccc2c(c1)oc1c3oc(-c4ccnc(-c5cc(C(=O)O)ccn5)c4)nc3c3[nH]c4ccccc4c3c21,C1CCOC1,425.0
CCCCN(CCCC)c1ccc2c3ccc4c5c(ccc(c6cccc1c62)c53)C(=O)OC4=O,CS(C)=O,561.0
CCCCN(CCCC)c1ccc2nc3c4ccccc4c(=O)c(-c4c5ccccc5cc5ccccc45)c-3oc2c1,ClCCl,555.0
CCCCN(CCCC)c1ccc2nc3c4ccccc4c(=O)c(-c4ccc5c(c4)C(CCCC)(CCCC)c4ccccc4-5)c-3oc2c1,ClCCl,551.0
CCCCN(CCCC)c1ccc2nc3c4ccccc4c(=O)c(-c4ccccc4)c-3oc2c1,ClCCl,549.0
CCCCN(CCCC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,ClCCl,543.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,C1CCOC1,466.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,C1COCCO1,474.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CC#N,434.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CC(C)=O,464.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CCOC(C)=O,460.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CN(C)C=O,424.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,CS(C)=O,433.0
CCCCN(c1ccccc1)c1ccc2c(c1)C(CC)(CC)c1cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc1-2,ClCCl,486.0
CCCCN1/C(=C/C2=C([O-])/C(=C/C3=[N+](CCC(=O)O)c4ccccc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2cc3ccccc3cc21,ClCCl,692.0
CCCCN1/C(=C/C2=C([O-])/C(=C/C3=[N+](CCC(=O)O)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc3ccccc3cc21,ClCCl,651.0
CCCCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CCCC)c4ccc(C(=O)O)cc4C3(C)C)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,642.0
CCCCN1/C(=C/C2C(=O)/C(=C\c3cc(C(C)(C)C)[o+]c(C(C)(C)C)c3)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,ClC(Cl)Cl,688.0
CCCCN1/C(=C/C2C(=O)/C(=C\c3cc(C(C)(C)C)[s+]c(C(C)(C)C)c3)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,ClC(Cl)Cl,745.0
CCCCN1/C(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2c1ccc1ccccc21,CS(C)=O,572.0
CCCCN1/C(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2cc(Br)ccc21,CS(C)=O,556.0
CCCCN1/C(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2cc(OC)ccc21,CS(C)=O,566.0
CCCCN1/C(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CS(C)=O,552.0
CCCCN1/C(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)Oc2ccccc21,CS(C)=O,516.0
CCCCN1/C(=C\C2C(=O)C(=Cc3cc(C(C)(C)C)[o+]c(C(C)(C)C)c3)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,ClC(Cl)Cl,688.0
CCCCN1/C(=C\C2C(=O)C(=Cc3cc(C(C)(C)C)[s+]c(C(C)(C)C)c3)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,ClC(Cl)Cl,745.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,C1CCOC1,684.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,CC#N,679.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,CC(C)=O,682.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,CCO,685.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,CN(C)C=O,686.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,CO,681.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,CS(C)=O,689.0
CCCCN1/C(=C\C=C\C=C\C2=[N+](CCCC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,ClCCl,695.0
CCCCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,C1CCCCC1,357.0
CCCCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,Cc1ccccc1,361.0
CCCCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,ClCCl,509.0
CCCCN1B2C(=Cc3ccccc31)C(c1ccccc1)=C(c1ccccc1)c1ccccc12,ClCCl,390.0
CCCCN1B2OB3C(=Cc4ccccc4N3CCCC)C(c3ccccc3)=C(c3ccccc3)C2=Cc2ccccc21,ClCCl,418.0
CCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCC)c4ccccc4C3)C2=C(C#N)C#N)C(C)(C)c2cc(C(=O)O)ccc21,ClC(Cl)Cl,705.0
CCCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCC)c4ccccc4C3)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,642.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CC#N,540.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CCCCCC,678.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CCO,492.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CN(C)C=O,549.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CO,483.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,Cc1ccccc1,689.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,ClC(Cl)Cl,658.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,ClCCl,642.0
CCCCN1C(=O)C(=C/C=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,OCC(F)(F)F,464.0
CCCCN1C(=O)C(=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CCCCCC,574.0
CCCCN1C(=O)C(=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CCO,452.0
CCCCN1C(=O)C(=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CN(C)C=O,497.0
CCCCN1C(=O)C(=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,Cc1ccccc1,575.0
CCCCN1C(=O)C(=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,ClC(Cl)Cl,559.0
CCCCN1C(=O)C(=C/C=C/C=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,ClCCl,550.0
CCCCN1C(=O)C(=CC=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CCCCCC,470.0
CCCCN1C(=O)C(=CC=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CCO,424.0
CCCCN1C(=O)C(=CC=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,CN(C)C=O,431.0
CCCCN1C(=O)C(=CC=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,Cc1ccccc1,468.0
CCCCN1C(=O)C(=CC=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,ClC(Cl)Cl,461.0
CCCCN1C(=O)C(=CC=C2N(CCCC)c3ccccc3N2CCCC)C(=O)N(CCCC)C1=S,ClCCl,456.0
CCCCN1C(=O)C(=Cc2cc3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3s2)C(C)=C(C#N)C1=O,ClC(Cl)Cl,571.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)o4)cc3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)cc1,ClCCl,525.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)o4)cc3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,514.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)cc1,ClCCl,524.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)cc1,ClCCl,627.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)s1,ClCCl,627.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(C=O)s4)s3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)cc2)s1,ClCCl,643.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4)cc3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1,ClCCl,511.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)cc4)s3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,ClCCl,627.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)N(CCCC)C(=O)C2=C1c1ccc(-c2ccc(C=C(C#N)C(=O)O)cc2)cc1,ClCCl,500.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)NC(=O)C2=C1c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1,ClCCl,497.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)[N-]C(=O)C2=C1c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1,ClCCl,594.0
CCCCN1C(=O)C2=C(c3ccc(-c4ccccc4)cc3)[N-]C(=O)C2=C1c1ccc(-c2ccccc2)cc1,ClCCl,585.0
CCCCN1C(=O)C2=C(c3ccc(Br)cc3)[N-]C(=O)C2=C1c1ccc(Br)cc1,ClCCl,571.0
CCCCN1C(=O)c2c(Br)c(Br)c3c4c(Br)c(Br)c5c6c(c(Br)c(Br)c(c7c(Br)c(Br)c(c2c37)C1=O)c64)C(=O)N(CCCC)C5=O,ClC(Cl)Cl,538.0
CCCCN1C(=O)c2cc(Br)c3c4c(Br)c(Br)c5c6c(cc(Br)c(c7c(Br)c(Br)c(c2c37)C1=O)c64)C(=O)N(CCCC)C5=O,ClC(Cl)Cl,534.0
CCCCN1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c(=O)n6c(c7cc(Oc8ccc(C(C)(C)C)cc8)c(c8c(Oc9ccc(C(C)(C)C)cc9)cc(c2c38)C1=O)c4c57)=Cc1ccc2ccccc2[n+]1[B-]6(F)F,ClCCl,648.0
CCCCN1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c(=O)n6c(c7cc(Oc8ccc(C(C)(C)C)cc8)c(c8c(Oc9ccc(C(C)(C)C)cc9)cc(c2c38)C1=O)c4c57)=Cc1cccc[n+]1[B-]6(F)F,ClCCl,624.0
CCCCN1C(=O)c2cc(Oc3ccc(C(C)(C)C)cc3)c3c4c(Oc5ccc(C(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)C)cc7)c(c7c(Oc8ccc(C(C)(C)C)cc8)cc(c2c37)C1=O)c64)C(=O)N(CCCC)C5=O,ClC(Cl)Cl,582.0
CCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCC)C5=O,ClC(Cl)Cl,526.0
CCCCN1C(=O)c2cccc3c(C#CC#Cc4ccc5c6c(cccc46)C(=O)N(CCCC)C5=O)ccc(c23)C1=O,ClCCl,372.0
CCCCN1C(=O)c2cccc3c(N(C)C)ccc(c23)C1=O,CC#N,416.0
CCCCN1C(=O)c2cccc3c(N(C)C)ccc(c23)C1=O,CS(C)=O,428.0
CCCCN1C(=O)c2cccc3c(N(C)C)ccc(c23)C1=O,Cc1ccccc1,403.0
CCCCN1C(=O)c2cccc3c(Oc4cc(CO)cc(Oc5ccc6c7c(cccc57)C(=O)N(CCCC)C6=O)c4)ccc(c23)C1=O,CC#N,358.0
CCCCN1C(=O)c2cccc3c(Oc4cc(CO)cc(Oc5ccc6c7c(cccc57)C(=O)N(CCCC)C6=O)c4)ccc(c23)C1=O,CN(C)C=O,360.0
CCCCN1C(=O)c2cccc3c(Oc4cc(CO)cc(Oc5ccc6c7c(cccc57)C(=O)N(CCCC)C6=O)c4)ccc(c23)C1=O,ClC(Cl)Cl,360.0
CCCCN1C(=O)c2cccc3c(Oc4cc(COc5ccc(N6C(=O)c7cccc8c(NCCN(C)C)ccc(c78)C6=O)cc5)cc(Oc5ccc6c7c(cccc57)C(=O)N(CCCC)C6=O)c4)ccc(c23)C1=O,CC#N,430.0
CCCCN1C(=O)c2cccc3c(Oc4cc(COc5ccc(N6C(=O)c7cccc8c(NCCN(C)C)ccc(c78)C6=O)cc5)cc(Oc5ccc6c7c(cccc57)C(=O)N(CCCC)C6=O)c4)ccc(c23)C1=O,CN(C)C=O,430.0
CCCCN1C(=O)c2cccc3c(Oc4cc(COc5ccc(N6C(=O)c7cccc8c(NCCN(C)C)ccc(c78)C6=O)cc5)cc(Oc5ccc6c7c(cccc57)C(=O)N(CCCC)C6=O)c4)ccc(c23)C1=O,ClC(Cl)Cl,430.0
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,C1CCOC1,586.7465224
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,CC#N,564.6058733
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,CC(C)=O,572.488408
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,CCO,555.6800618
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,CO,545.8268934
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,CS(C)=O,566.8083462
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,Cc1ccccc1,607.2642968
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,ClC(Cl)Cl,589.5285935
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,ClCCl,584.7758887
CCCCN1C(=O)c2cccc3c([O-])c(/C=C/c4sc5ccccc5[n+]4CC)cc(c23)C1=O,O,489.4899536
CCCCN1C(=O)c2cccc3cc(C#CC#Cc4cc5c6c(cccc6c4)C(=O)N(CCCC)C5=O)cc(c23)C1=O,ClCCl,314.0
CCCCN1C(=O)c2cccc3cccc(c23)C1=O,CC#N,341.0
CCCCN1C(=O)c2cccc3cccc(c23)C1=O,CS(C)=O,342.0
CCCCN1C(=O)c2cccc3cccc(c23)C1=O,Cc1ccccc1,342.0
CCCCN1C(=S)c2cccc3c(OC)ccc(c23)C1=S,CC#N,476.0
CCCCN1C(=S)c2cccc3c(OC)ccc(c23)C1=S,CS(C)=O,483.0
CCCCN1C(=S)c2cccc3c(OC)ccc(c23)C1=S,Cc1ccccc1,468.0
CCCCN1C(=S)c2cccc3cccc(c23)C1=S,CC#N,437.0
CCCCN1C(=S)c2cccc3cccc(c23)C1=S,CS(C)=O,443.0
CCCCN1C(=S)c2cccc3cccc(c23)C1=S,Cc1ccccc1,442.0
CCCCN1C=C/C(=C/C2C(=O)C(=CC3=[N+](CCCC)c4ccc(C(=O)O)cc4C3(C)C)C2[O-])c2ccccc21,CCO,742.0
CCCCN1[C@H]2CC[C@@H]([C@H]3CC[C@@H]4[C@H]5CC[C@H]([C@H]6CC[C@@H](/C=C(\C#N)C(=O)O)S6)C[C@@H]5C5(OCCO5)C5(OCCO5)[C@@H]4C3)C[C@H]2S[C@H]2CCCC[C@H]21,ClCCl,460.0
CCCCN1c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)cc4)s3)cc2Sc2cc(-c3nc4ccccc4n3-c3ccccc3)ccc21,C1CCOC1,399.0
CCCCN1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)c4nsnc34)cc2Sc2cc(N(c3ccccc3)c3ccccc3)ccc21,C1CCOC1,469.0
CCCCN1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)s3)cc2Sc2cc(-c3nc4ccccc4n3-c3ccccc3)ccc21,C1CCOC1,399.0
CCCCN1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2Sc2cc(-c3nc4ccccc4n3-c3ccccc3)ccc21,C1CCOC1,459.0
CCCCN1c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2Sc2cc(-c3nc4ccccc4n3-c3ccccc3)ccc21,C1CCOC1,402.0
CCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2Sc2cc(-c3nc4ccccc4n3-c3ccccc3)ccc21,C1CCOC1,402.0
CCCCN1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2Sc2cc(-c3nc4ccccc4n3-c3ccccc3)ccc21,C1CCOC1,438.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2C(C)(C)c2cc(-c3ccc(C=O)cc3)ccc21,C1CCOC1,395.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2C(C)(C)c2cc(-c3ccc(C=O)cc3)ccc21,CC#N,394.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2C(C)(C)c2cc(-c3ccc(C=O)cc3)ccc21,CC(C)=O,396.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2C(C)(C)c2cc(-c3ccc(C=O)cc3)ccc21,CCCCCC,383.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2C(C)(C)c2cc(-c3ccc(C=O)cc3)ccc21,CS(C)=O,408.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2C(C)(C)c2cc(-c3ccc(C=O)cc3)ccc21,Cc1ccccc1,393.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2Oc2cc(-c3ccc(C=O)cc3)ccc21,C1CCOC1,432.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2Oc2cc(-c3ccc(C=O)cc3)ccc21,CC#N,429.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2Oc2cc(-c3ccc(C=O)cc3)ccc21,CC(C)=O,427.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2Oc2cc(-c3ccc(C=O)cc3)ccc21,CCCCCC,414.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2Oc2cc(-c3ccc(C=O)cc3)ccc21,CS(C)=O,441.0
CCCCN1c2ccc(-c3ccc(C=O)cc3)cc2Oc2cc(-c3ccc(C=O)cc3)ccc21,Cc1ccccc1,429.0
CCCCN1c2ccc(/C=C(/C#N)C(=O)O)cc2Sc2cc(-n3c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)ccc43)ccc21,ClCCl,448.0
CCCCN1c2ccc(/C=C(/C#N)C(=O)O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,456.0
CCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21,C1CCOC1,498.0
CCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,456.0
CCCCN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2ccc(SC)cc21,ClCCl,451.0
CCCCN1c2ccc(/C=C/c3cc(=O)oc4cc(C)ccc34)cc2Sc2cc(/C=C/c3cc(=O)oc4cc(C)ccc34)ccc21,ClC(Cl)Cl,441.0
CCCCN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)ccc43)ccc21,ClCCl,455.0
CCCCN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,481.0
CCCCN1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)cc4c4cc(-n5c6ccc(C(C)(C)C)cc6c6cc(C(C)(C)C)ccc65)ccc43)ccc21,ClCCl,455.0
CCCCN1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)ccc21,ClCCl,481.0
CCCCN1c2ccccc2B(c2ccccc2C(F)(F)F)c2ccccc21,ClCCl,386.0
CCCCN1c2ccccc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21,C1CCOC1,464.0
CCCCN1c2ccccc2Sc2cc(-c3ccc(-c4cc5c(s4)c4sc(/C=C(/C#N)C(=O)O)cc4n5-c4ccc5c(c4)C(CCCC)(CCCC)c4ccccc4-5)s3)ccc21,C1CCOC1,493.0
CCCCN1c2ccccc2Sc2cc(-c3ccc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5-c4ccc5c(c4)C(CCCC)(CCCC)c4ccccc4-5)s3)ccc21,C1CCOC1,493.0
CCCCN1c2ccccc2Sc2cc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc21,C1CCOC1,444.0
CCCCN1c2ccccc2Sc2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)c4nsnc34)ccc21,C1CCOC1,452.0
CCCCN1c2ccccc2Sc2cc(-c3ccc(/C=C(/C(=O)O)C(F)(F)F)s3)ccc21,ClCCl,424.0
CCCCN1c2ccccc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)o3)ccc21,ClCCl,442.0
CCCCN1c2ccccc2Sc2cc(-c3ccc(/C=C(\C(=O)O)C(F)(F)F)s3)ccc21,ClCCl,424.0
CCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc3-4)ccc21,ClCCl,471.0
CCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)ccc21,ClCCl,441.0
CCCCN1c2ccccc2Sc2cc(-c3ccc4c(c3)C3(OCCO3)C3(OCCO3)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)ccc21,ClCCl,460.0
CCCCN1c2ccccc2Sc2cc(-c3nc4c(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)s5)ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)c4n3CCCC)ccc21,C1CCOC1,444.0
CCCCN1c2ccccc2Sc2cc(-c3nc4c(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)c4n3CCCC)ccc21,C1CCOC1,444.0
CCCCN1c2ccccc2Sc2cc(-c3nc4c(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c4n3CCCC)ccc21,C1CCOC1,427.0
CCCCN1c2ccccc2Sc2cc(-c3sc(/C=C(\C#N)C(=O)O)c4c3OCCO4)ccc21,ClCCl,466.0
CCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)c(SCC)cc21,ClCCl,472.0
CCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,C1CCOC1,437.0
CCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,452.3333333333333
CCCCN1c2ccccc2Sc2cc(/C=C/C3=Nc4ccc5ccccc5c4C3(C)C)ccc21,C1CCCCC1,414.0
CCCCN1c2ccccc2Sc2cc(/C=C/C3=Nc4ccc5ccccc5c4C3(C)C)ccc21,C1COCCO1,417.0
CCCCN1c2ccccc2Sc2cc(/C=C/C3=Nc4ccc5ccccc5c4C3(C)C)ccc21,CCOC(C)=O,416.0
CCCCN1c2ccccc2Sc2cc(/C=C/C3=Nc4ccc5ccccc5c4C3(C)C)ccc21,CCOCC,414.0
CCCCN1c2ccccc2Sc2cc(/C=C/C3=Nc4ccc5ccccc5c4C3(C)C)ccc21,Cc1ccccc1,423.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)cc3)ccc21,ClCCl,457.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,494.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3ccc(/C=C/c4ccncc4)c4nsnc34)ccc21,ClCCl,488.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,C1CCCCC1,454.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,C1CCOC1,467.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,C1COCCO1,463.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,CC#N,462.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,CC(C)=O,464.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,CC(C)O,479.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,CCOC(C)=O,463.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,CCOCC,458.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,CO,478.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,CS(C)=O,481.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,Cc1ccccc1,467.0
CCCCN1c2ccccc2Sc2cc(/C=C/c3nc4nc5ccccc5nc4s3)ccc21,ClCCl,472.0
CCCCN1c2ccccc2Sc2cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)ccc21,ClCCl,481.0
CCCCN1c2ccccc2Sc2cc(/C=C\c3cc(=O)oc4cc(C)ccc34)ccc21,ClC(Cl)Cl,424.0
CCCCN1c2ccccc2Sc2cc(/C=C\c3cc(=O)oc4ccc(C)cc34)ccc21,ClC(Cl)Cl,423.0
CCCCN1c2ccccc2Sc2cc(C#Cc3ccc(C=C(C#N)C(=O)O)s3)ccc21,ClCCl,465.0
CCCCN1c2ccccc2Sc2cc(C=C(C#N)C(=O)O)c(SCC)cc21,ClCCl,472.0
CCCCN1c2ccccc2Sc2cc(C=C(C#N)C(=O)O)ccc21,ClCCl,456.0
CCCCN1c2ccccc2Sc2cc(C=Cc3ccc(C=C(C#N)C(=O)O)s3)ccc21,ClCCl,494.0
CCCCN1c2ccccc2Sc2ccc(/C=C(\C#N)C(=O)O)cc21,C1CCOC1,437.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,C1CCOC1,372.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,C1COCCO1,373.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CC#N,373.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CC(C)=O,372.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CCCCCC,371.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CCO,372.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CN(C)C=O,375.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CO,372.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CS(C)=O,376.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,Cc1ccccc1,376.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,ClC(Cl)Cl,376.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,ClCCl,378.0
CCCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,OCC(F)(F)F,363.0
CCCCNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,C1COCCO1,332.0
CCCCNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,CC#N,333.0
CCCCNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,CO,335.0
CCCCNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,ClCCl,338.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,C1CCCCC1,646.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,C1COCCO1,644.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CC(C)=O,642.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CCCCCCCCCCO,649.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CCCCCCCO,648.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CCCCCCO,647.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CCCCO,646.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CCO,643.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CN(C)C=O,643.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CO,640.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,CS(C)=O,645.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,ClC(Cl)(Cl)Cl,649.0
CCCCNc1ccc(NCCCC)c2c1C(=O)c1ccccc1C2=O,c1ccccc1,648.0
CCCCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(O)cc1)C2=O,CC#N,430.0
CCCCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(O)cc1)C2=O,CN(C)C=O,438.0
CCCCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(O)cc1)C2=O,ClC(Cl)Cl,428.0
CCCCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(OCc3cc(Oc4ccc5c6c(cccc46)C(=O)N(CCCC)C5=O)cc(Oc4ccc5c6c(cccc46)C(=O)N(CCCC)C5=O)c3)cc1)C2=O,CC#N,430.0
CCCCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(OCc3cc(Oc4ccc5c6c(cccc46)C(=O)N(CCCC)C5=O)cc(Oc4ccc5c6c(cccc46)C(=O)N(CCCC)C5=O)c3)cc1)C2=O,CN(C)C=O,438.0
CCCCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(OCc3cc(Oc4ccc5c6c(cccc46)C(=O)N(CCCC)C5=O)cc(Oc4ccc5c6c(cccc46)C(=O)N(CCCC)C5=O)c3)cc1)C2=O,ClC(Cl)Cl,426.0
CCCCNc1nc(/C=C/c2ccccc2)[n+]([O-])c2c1CCCC2,ClCCl,415.0
CCCCNc1nn(-c2ccc(OC)cc2)nc1C#N,CC#N,328.0
CCCCO,CCCCO,425.0
CCCCO/C1=C2\C=CC(=N2)/C(c2ccccc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccccc1)=C1/C=CC(=N1)C=3\C=C(/C#N)C(=O)O,CCO,626.0
CCCCO/C1=C2\C=CC(=N2)/C(c2ccccc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(c1ccccc1)=C1/C=CC(=N1)C=3\C=C\C(=O)O,CCO,619.0
CCCCOC(=O)/C(C#N)=C1\C(=CC2=[N+](C)c3ccccc3C2(C)C)C([O-])=C1C=C1N(C)c2ccccc2C1(C)C,ClC(Cl)Cl,691.0
CCCCOC(=O)/C(C#N)=C1\C(=O)C([O-])=C1C=C1N(C)c2ccccc2C1(C)C,CCO,462.0
CCCCOC(=O)/C=C/c1c(C(=O)OC)cc2ccccn12,ClCCl,394.0
CCCCOC(=O)/C=C/c1cc(C(=O)OC)c2c3ccccc3ccn12,ClCCl,381.0
CCCCOC(=O)/C=C/c1nc2c(N(C)C)nc(N(C)C)nc2n1CCCC,ClCCl,417.0
CCCCOC(=O)/C=C/c1nc2c([nH]1)CN(CC)C(=O)N2CC,ClCCl,349.0
CCCCOC(=O)/C=C/c1nc2c(c(=O)n(CCCC)c(=O)n2C)n1C,ClCCl,353.0
CCCCOC(=O)CCCN1C(=CC2=C([O-])C(=CC3=[N+](CCCC(=O)OCCCC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2ccccc21,CCO,631.0
CCCCOC(=O)c1cc(Cl)c2c3c(Cl)cc4c5c(cc(Cl)c(c6c(Oc7ccc(C(=O)OC)cc7)cc(C(=O)OCCCC)c1c26)c53)C(=O)N(c1c(C(C)C)cccc1C(C)C)C4=O,Cc1ccccc1,507.0
CCCCOC(=O)c1cc(Cl)c2c3c(Cl)cc4c5c(cc(Cl)c(c6c(Oc7ccc(OC)cc7)cc(C(=O)OCCCC)c1c26)c53)C(=O)N(c1c(C(C)C)cccc1C(C)C)C4=O,Cc1ccccc1,519.0
CCCCOC(=O)c1cc(Oc2ccc(C(C)(C)C)cc2)c2c3c(Cl)cc4c5c(cc(Cl)c(c6c(Oc7ccc(C(C)(C)C)cc7)cc(C(=O)OCCCC)c1c26)c53)C(=O)N(c1c(C(C)C)cccc1C(C)C)C4=O,Cc1ccccc1,529.0
CCCCOC(=O)c1cc(Oc2ccc(OC)cc2)c2c3c(Cl)cc4c5c(cc(Cl)c(c6c(Oc7ccc(OC)cc7)cc(C(=O)OCCCC)c1c26)c53)C(=O)N(c1c(C(C)C)cccc1C(C)C)C4=O,Cc1ccccc1,531.0
CCCCOCNc1ccc2c3c(cccc13)C(=O)c1ccccc1-2,c1ccccc1,498.0
CCCCOc1c(-c2ccc(C=O)cc2)cc2cc(-c3ccc(C=O)cc3)c(OCCCC)c3c4c(OCCCC)c(-c5ccc(C=O)cc5)cc5cc(-c6ccc(C=O)cc6)c(OCCCC)c(c1c23)c54,ClCCl,452.0
CCCCOc1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(OCCCC)c3c4c(OCCCC)c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc5cc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)c(OCCCC)c(c1c23)c54,ClCCl,422.0
CCCCOc1c(Br)cc2cc(Br)c(OCCCC)c3c4c(OCCCC)c(Br)cc5cc(Br)c(OCCCC)c(c1c23)c54,ClCCl,443.0
CCCCOc1c(C#N)cc2cc(C#N)c(OCCCC)c3c4c(OCCCC)c(C#N)cc5cc(C#N)c(OCCCC)c(c1c23)c54,ClCCl,454.0
CCCCOc1c(C=C2C=Cc3ccccc3N2C)c(=O)c1=O,CCO,465.0
CCCCOc1c(C=C2N(C)c3ccccc3C2(C)C)c(=O)c1=O,CCO,425.0
CCCCOc1c(C=C2N(C)c3ccccc3C2(C)C)c(=O)c1=S,CCO,500.0
CCCCOc1c(C=C2Sc3ccccc3N2C)c(=O)c1=O,CCO,442.0
CCCCOc1c(OC)cc2cc(OC)c(OCCCC)c3c4c(OCCCC)c(OC)cc5cc(OC)c(OCCCC)c(c1c23)c54,ClCCl,451.0
CCCCOc1c2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc1Cc1cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc(c1OCCCC)Cc1cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc(c1OCCCC)Cc1cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc(c1OCCCC)C2,ClC(Cl)Cl,468.0
CCCCOc1c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc1Cc1cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc(c1OCCCC)Cc1cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc(c1OCCCC)Cc1cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc(c1OCCCC)C2,ClC(Cl)Cl,447.0
CCCCOc1cc(/C=C/c2cc(OC)c(N(CCCC)CCCC)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,C1CCOC1,380.0
CCCCOc1cc(/C=C/c2cc(OC)c(N(CCCC)CCCC)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,CC#N,374.0
CCCCOc1cc(/C=C/c2cc(OC)c(N(CCCC)CCCC)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,Cc1ccccc1,380.0
CCCCOc1cc(/C=C/c2cc(OC)c(N(CCCC)CCCC)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,ClCCl,381.0
CCCCOc1cc(/C=C/c2cc(OC)c(N3CCCC3)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,C1CCOC1,418.0
CCCCOc1cc(/C=C/c2cc(OC)c(N3CCCC3)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,CC#N,417.0
CCCCOc1cc(/C=C/c2cc(OC)c(N3CCCC3)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,Cc1ccccc1,420.0
CCCCOc1cc(/C=C/c2cc(OC)c(N3CCCC3)cc2OC)c(OCCCC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,ClCCl,429.0
CCCCOc1cc(/C=C/c2ccnc(-c3cc(C)ccn3)c2)c(OCCCC)cc1/C=C/c1ccc(N(CCCC)CCCC)cc1,C1CCOC1,418.0
CCCCOc1cc(/C=C/c2ccnc(-c3cc(C)ccn3)c2)c(OCCCC)cc1/C=C/c1ccc(N(CCCC)CCCC)cc1,CC#N,415.0
CCCCOc1cc(/C=C/c2ccnc(-c3cc(C)ccn3)c2)c(OCCCC)cc1/C=C/c1ccc(N(CCCC)CCCC)cc1,Cc1ccccc1,419.0
CCCCOc1cc(/C=C/c2ccnc(-c3cc(C)ccn3)c2)c(OCCCC)cc1/C=C/c1ccc(N(CCCC)CCCC)cc1,ClCCl,428.0
CCCCOc1cc(C)c(C=Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1C,CO,423.0
CCCCOc1cc(C=C2c3ccccc3-c3ccccc32)c(OCCCC)cc1C=C1c2ccccc2C=Cc2ccccc21,C1CCOC1,395.0
CCCCOc1cc2ccccc2c2c1oc1cc3ccccc3cc12,C1CCOC1,351.0
CCCCOc1ccc(-c2cc(-c3ccc(OCCCC)cc3)c3ccc4c(-c5ccc(OCCCC)cc5)cc(-c5ccc(OCCCC)cc5)c5ccc2c3c54)cc1,ClC(Cl)Cl,394.0
CCCCOc1ccc(-c2cc3c(o2)c(-c2ccc(OCCCC)cc2)c2n3[B-](F)(F)[N+]3=Cc4c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)cc5n4[B-](F)(F)[N+]3=C2)cc1,C1CCOC1,619.0
CCCCOc1ccc(-c2cc3c(o2)c(-c2ccc(OCCCC)cc2)c2n3[B-](F)(F)[N+]3=Cc4c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)cc5n4[B-](F)(F)[N+]3=C2)cc1,CN(C)C=O,620.0
CCCCOc1ccc(-c2cc3c(o2)c(-c2ccc(OCCCC)cc2)c2n3[B-](F)(F)[N+]3=Cc4c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)cc5n4[B-](F)(F)[N+]3=C2)cc1,CS(C)=O,625.0
CCCCOc1ccc(-c2cc3c(o2)c(-c2ccc(OCCCC)cc2)c2n3[B-](F)(F)[N+]3=Cc4c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)cc5n4[B-](F)(F)[N+]3=C2)cc1,Cc1ccccc1,626.0
CCCCOc1ccc(-c2cc3c(o2)c(-c2ccc(OCCCC)cc2)c2n3[B-](F)(F)[N+]3=Cc4c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)cc5n4[B-](F)(F)[N+]3=C2)cc1,ClC(Cl)Cl,624.0
CCCCOc1ccc(-c2cc3c(o2)c(-c2ccc(OCCCC)cc2)c2n3[B-](F)(F)[N+]3=Cc4c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)cc5n4[B-](F)(F)[N+]3=C2)cc1,ClCCl,622.0
CCCCOc1ccc(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)cc1,ClC(Cl)Cl,498.0
CCCCOc1ccc(-c2ccc(C=C(C#N)C(=O)O)s2)c(OCCCC)c1,CCO,390.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6cc(C(=O)O)nc(C(=O)O)c6)s5)s4)cc3)c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)cc2)c(OCCCC)c1,ClCCl,456.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(-c5ccc(-c6ccc(-c7ccncc7)s6)c6nsnc56)s4)cc3)c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)cc2)c(OCCCC)c1,C1CCOC1,520.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)c(OCCCC)c1,ClCCl,504.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)cc2)c(OCCCC)c1,CCO,445.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)cc2)c(OCCCC)c1,ClCCl,500.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(N(C)C)cc4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)c(OCCCC)c1,CCO,459.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)o5)c5nsnc45)cc3)cc2)c(OCCCC)c1,ClCCl,534.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)cc3)cc2)c(OCCCC)c1,ClCCl,532.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)Oc4cc(-c6ccc(/C=C(\C#N)C(=O)O)s6)ccc4N5CC(CC)CCCC)cc3)c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)cc2)c(OCCCC)c1,ClCCl,503.0
CCCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc5c(c4)Oc4cc(/C=C(\C#N)C(=O)O)ccc4N5CC(CC)CCCC)cc3)c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)cc2)c(OCCCC)c1,ClCCl,479.0
CCCCOc1ccc(-c2ccc(N(c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(OCCCC)cc4OCCCC)cc3)cc2)c(OCCCC)c1,CO,502.0
CCCCOc1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)ccc2N3CCCC)c(OCCCC)c1,ClCCl,498.0
CCCCOc1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2N3CCCC)c(OCCCC)c1,ClCCl,457.0
CCCCOc1ccc(-c2oc3c(-c4ccc(OCCCC)cc4)c4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,C1CCOC1,619.0
CCCCOc1ccc(-c2oc3c(-c4ccc(OCCCC)cc4)c4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CN(C)C=O,621.0
CCCCOc1ccc(-c2oc3c(-c4ccc(OCCCC)cc4)c4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CS(C)=O,623.0
CCCCOc1ccc(-c2oc3c(-c4ccc(OCCCC)cc4)c4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,Cc1ccccc1,631.0
CCCCOc1ccc(-c2oc3c(-c4ccc(OCCCC)cc4)c4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,ClC(Cl)Cl,627.0
CCCCOc1ccc(-c2oc3c(-c4ccc(OCCCC)cc4)c4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OCCCC)cc5)c5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,ClCCl,624.0
CCCCOc1ccc(-c2oc3cc4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3cc5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,C1CCOC1,596.0
CCCCOc1ccc(-c2oc3cc4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3cc5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CN(C)C=O,593.0
CCCCOc1ccc(-c2oc3cc4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3cc5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CS(C)=O,594.0
CCCCOc1ccc(-c2oc3cc4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3cc5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,Cc1ccccc1,608.0
CCCCOc1ccc(-c2oc3cc4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3cc5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,ClC(Cl)Cl,610.0
CCCCOc1ccc(-c2oc3cc4n(c3c2-c2ccc(OCCCC)cc2)[B-](F)(F)[N+]2=Cc3cc5oc(-c6ccc(OCCCC)cc6)c(-c6ccc(OCCCC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,ClCCl,606.0
CCCCOc1ccc(-c2sc(/C=C(\C#N)C(=O)O)c3c2OCCO3)c(OCCCC)c1,CN(C)C=O,408.0
CCCCOc1ccc(-c2sc(/C=C3/SC(=O)N(CC(=O)O)C3=S)c3c2OCCO3)c(OCCCC)c1,CN(C)C=O,482.0
CCCCOc1ccc(/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccccc2)=C2/C=CC(=N2)/C=4C=CC(=O)O)cc1,CCO,430.0
CCCCOc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(I)cc4)c4c(/C=C/c5ccc(N(C)C)cc5)cc(/C=C/c5ccc(OC)cc5)n4[B-]3(F)F)C(/C=C/c3ccc(OCCOCCOC)cc3)=C2)cc1,C1COCCO1,700.0
CCCCOc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,565.0
CCCCOc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,429.0
CCCCOc1ccc(N(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1,ClC(Cl)Cl,506.0
CCCCOc1ccc(N(c2ccc(/C=C/c3cc(OCC)c(/C=C(/C#N)C(=O)O)cc3OCC)cc2)c2ccc(OCCCC)cc2)cc1,ClCCl,505.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc(-c3c(-c4ccc(-c5ccc(-c6cccs6)s5)s4)sc(-c4ccsc4-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)c3-c3ccc(N(c4ccc(OCCCC)cc4)c4ccc(OCCCC)cc4)cc3)cc2)cc1,C1CCOC1,496.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc(-c3ccc(-c4ccc5c(c4)C4(OCCO4)C4(OCCO4)c4cc(-c6ccc(/C=C(\C#N)C(=O)O)s6)ccc4-5)s3)cc2)cc1,ClC(Cl)Cl,420.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc(-c3ccc(-c4ccc5c(c4)C4(OCCO4)C4(OCCO4)c4cc(-c6ccc(/C=C(\C#N)C(=O)O)s6)ccc4-5)s3)cc2)cc1,ClCCl,420.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1,ClC(Cl)Cl,510.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,ClC(Cl)Cl,510.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc(-c3ccc4c(c3)C3(OCCO3)C3(OCCO3)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)cc2)cc1,ClC(Cl)Cl,418.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc(-c3ccc4c(c3)C3(OCCO3)C3(OCCO3)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)cc2)cc1,ClCCl,418.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc3c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4n(CCCC)c3c2)cc1,ClCCl,485.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc3c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4n(CCCC)c3c2)cc1,ClCCl,495.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc3nc(/C=C(/C#N)C(=O)O)ccc3c2)cc1,ClC(Cl)Cl,466.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc3nc(/C=C(\C#N)C(=O)O)ccc3c2)cc1,ClC(Cl)Cl,466.0
CCCCOc1ccc(N(c2ccc(OCCCC)cc2)c2ccc3nc(/C=C(\C#N)C(=O)O)ncc3c2)cc1,ClC(Cl)Cl,438.0
CCCCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,C1CCOC1,343.0
CCCCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CCCCCC,338.0
CCCCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CCO,344.0
CCCCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CS(C)=O,346.0
CCCCOc1cccc(OCCCC)c1-c1cc(-c2ccc3c(c2)c2ccccc2n3CC)sc1-c1sc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1-c1c(OCCCC)cccc1OCCCC,ClCCl,498.0
CCCCOc1cccc(OCCCC)c1/C1=C2\C=CC(=N2)/C(C#Cc2ccc(C(=O)O)cc2)=c2/cc/c3n2[Zn]n2c(ccc21)/C(C#Cc1ccc(N(C)C)cc1)=C1/C=CC(=N1)/C=3c1c(OCCCC)cccc1OCCCC,C1CCOC1,667.0
CCCCOc1ccccc1/C1=C2\C=CC(=N2)/C(c2ccccc2OCCCC)=c2/cc/c3n2[Zn]n2c1ccc2/C(c1ccccc1OCCCC)=C1\N=C(C=C1C#Cc1ccc(/C=C(\C#N)C(=O)O)cc1)/C=3c1ccccc1OCCCC,C1CCOC1,607.0
CCCCSC1=C(SCCCC)SC(=C(C(=C2SC(SCCCC)=C(SCCCC)S2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)s3)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)cc4)s3)cc2)S1,C1CCOC1,436.0
CCCCSC1=C(SCCCC)SC(=C(C(=C2SC(SCCCC)=C(SCCCC)S2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)S1,C1CCOC1,447.0
CCCCSC1=C(SCCCC)SC(=C(C(=C2SC(SCCCC)=C(SCCCC)S2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)s2)S1,C1CCOC1,488.0
CCCCSC1=C(SCCCC)SC(=C(C(=C2SC(SCCCC)=C(SCCCC)S2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)S1,C1CCOC1,447.0
CCCCSC1=C(SCCCC)SC(=C(C(=C2SC(SCCCC)=C(SCCCC)S2)c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(/C#N)C(=O)O)s4)ccc2-3)S1,C1CCOC1,439.0
CCCCSC1=C(SCCCC)SC(=C(C(=C2SC(SCCCC)=C(SCCCC)S2)c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)S1,C1CCOC1,439.0
CCCCSC1=C(SCCCC)SC(=Cc2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)S1,C1CCOC1,461.0
CCCCSC1=C(SCCCC)SC(=Cc2ccc(/C=C(\C#N)C(=O)O)s2)S1,C1CCOC1,448.0
CCCC[C@@H](CC)CN1C(=O)/C(=C2/C(=O)N(C[C@H](CC)CCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc32)c2ccc(-c3ccc4c(c3)[C@@H]3CCC[C@@H]3N4c3ccc(C)cc3)cc21,ClCCl,579.0
CCCC[C@@H](CC)CN1C(=O)/C(=C2/C(=O)N(C[C@H](CC)CCCC)c3cc(-c4ccc5c(c4)[C@@H]4CCC[C@@H]4N5c4ccc(C)cc4)ccc32)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc21,ClCCl,570.0
CCCC[C@@H](CC)Cn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc21,ClCCl,428.0
CCCC[C@@H](CC)Cn1c2cc(-c3ccc(/C=c4\sc(=C(C#N)C#N)[nH]c4=O)o3)ccc2c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc21,ClCCl,476.0
CCCC[C@@H](CC)Cn1c2cc(-c3ccc(/C=c4\sc(=C(C#N)C#N)[nH]c4=O)s3)ccc2c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc21,ClCCl,462.0
CCCC[C@@H](CC)Cn1nc2c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)sc3c3sc(-c4ccc(/C=C(/C#N)C(=O)O)s4)cc3c2n1,C1CCOC1,468.0
CCCC[C@H](C)Cc1ccc(-c2ccc(-c3cc4c(cc(-c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)cc5)n4-c4ccc(OC[C@@H](CC)CCCC)cc4)n3-c3ccc(OC[C@@H](CC)CCCC)cc3)cc2)cc1,ClCCl,506.0
CCCC[C@H](CC)CN1C(=O)/C(=C2/C(=O)N(C[C@H](CC)CCCC)c3cc(-c4ccc(/C=C(\C#N)C(=O)O)o4)ccc32)c2ccc(-c3ccc4c(c3)[C@@H]3CCC[C@@H]3N4c3ccc(C)cc3)cc21,ClCCl,579.0
CCCC[C@H](CC)CN1C(=O)C2=C(c3ccc(-c4cc5c6c7c4cccc7c4cccc7c(-c8ccc(OC)cc8)cc(c6c74)n5C[C@@H](CC)CCCC)cc3)N(C[C@@H](CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)cc1,ClC(Cl)Cl,526.0
CCCC[C@H](CC)CN1C(=O)C2=C(c3ccc(-c4cc5c6c7c4cccc7c4cccc7c(OC)cc(c6c74)n5C[C@@H](CC)CCCC)cc3)N(C[C@@H](CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,ClC(Cl)Cl,527.0
CCCC[C@H](CC)CN1C(=O)C2=C(c3ccc(-c4cc5c6c7c4cccc7c4cccc7ccc(c6c74)n5C[C@@H](CC)CCCC)cc3)N(C[C@@H](CC)CCCC)C(=O)C2=C1c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,ClC(Cl)Cl,522.0
CCCC[C@H](CC)CN1C(=O)C2=C(c3ccc(-c4ccc(C(=O)O)cc4)s3)N(C[C@H](CC)CCCC)C(=O)C2=C1c1ccc(-c2cc3c(s2)-c2ccc(N(c4ccc(C)cc4)c4ccc(C)cc4)cc2C3(c2ccc(C)cc2)c2ccc(C)cc2)s1,ClC(Cl)Cl,625.0
CCCC[C@H](CC)CN1c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,469.0
CCCC[C@H](CC)CN1c2ccc(/C=C(\C#N)C(=O)O)cc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,469.0
CCCC[C@H](CC)CN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)ccc21,ClCCl,484.0
CCCC[C@H](CC)CN1c2ccccc2Sc2cc(-c3ccc(/C=C(/C#N)C(=O)O)s3)ccc21,C1CCOC1,444.0
CCCC[C@H](CC)CN1c2ccccc2Sc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,C1CCOC1,444.0
CCCC[C@H](CC)CN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,462.0
CCCC[C@H](CC)CN1c2ccccc2Sc2cc(/C=C3/SC(=S)N(CC(=O)O)C3=O)ccc21,ClCCl,477.0
CCCC[C@H](CC)COc1ccc(-c2cc3c4c5c2cccc5c2cccc5c(-c6ccc(-c7ccc(-c8ccc(/C=C(\C#N)C(=O)O)s8)c8nc(-c9ccccc9)c(-c9ccccc9)nc78)s6)cc(c4c52)n3C[C@@H](CC)CCCC)cc1,C1CCOC1,525.0
CCCC[C@H](CC)COc1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(OC[C@@H](CC)CCCC)cc4)ccc2N3[C@H]2C=CC(c3ccc(C(=O)O)cc3)=CC2)cc1,C1CCOC1,290.0
CCCC[C@H](CC)COc1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(OC[C@@H](CC)CCCC)cc4)ccc2N3c2ccc(C(=O)O)cc2)cc1,C1CCOC1,290.0
CCCC[C@H](CC)COc1ccc(-n2c(-c3ccc(-c4ccc(C(=C(c5ccccc5)c5ccccc5)c5ccccc5)cc4)cc3)cc3c2cc(-c2ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc2)n3-c2ccc(OC[C@@H](CC)CCCC)cc2)cc1,ClCCl,412.0
CCCC[C@H](CC)COc1ccc(N(c2ccc(OC[C@@H](CC)CCCC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)s3)cc2)cc1,C1CCOC1,542.0
CCCC[C@H](CC)COc1ccc(N(c2ccc(OC[C@@H](CC)CCCC)cc2)c2ccc(-c3sc(/C=C(\C#N)C(=O)O)c4c3OC[C@]3(CO4)COc4c(/C=C(\C#N)C(=O)O)sc(-c5ccc(N(c6ccc(OC)cc6)c6ccc(OC)cc6)c6nsnc56)c4OC3)cc2)cc1,CS(C)=O,433.0
CCCC[C@H](CC)Cc1cc(-c2ccc(-c3cc(C[C@H](CC)CCCC)c(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)c3nsnc23)sc1-c1ccc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)s1,ClCCl,529.0
CCCC[C@H](CC)Cc1cc(-c2sc(-c3sc(-c4ccc5c(c4)c4ccccc4n5CC)cc3C[C@@H](CC)CCCC)cc2C[C@@H](CC)CCCC)sc1/C=C(\C#N)C(=O)O,ClC(Cl)Cl,470.0
CCCC[C@H](CC)Cc1cc(-c2sc(-c3sc(/C=C(/C#N)C(=O)O)cc3C[C@@H](CC)CCCC)cc2C[C@H](CC)CCCC)sc1-c1ccc2c(c1)c1ccccc1n2CC,ClC(Cl)Cl,451.0
CCCC[C@H](CC)Cn1c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2c2cc3c4cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc4n(C[C@H](CC)CCCC)c3cc21,ClCCl,467.0
CCCC[C@H](CC)Cn1nc2c3cc(-c4ccc5c6ccccc6n(C[C@@H](CC)CCCC)c5c4)sc3c3sc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3c2n1,C1CCOC1,470.0
CCCC[C@H](CC)Cn1nc2c3cc(/C=C(\C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c2n1,C1CCOC1,434.0
CCCC[N+]1=C(/C=C2/C(=O)C(O)=C2[O-])C(C)(C)c2ccccc21,CCO,423.0
CCCC[N+]1=C(/C=C2\C(=O)C(/C=C3/N(CC)c4ccccc4C3(C)C)=C2[O-])C(C)(C)c2cc(/C=C(\C#N)C(=O)O)ccc21,CCO,653.0
CCCC[N+]1=C(C=C2C(=O)C(/C=C3/C=C(c4ccccc4)Oc4ccccc43)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,679.0
CCCC[N+]1=C(C=C2C(=O)C(/C=C3/C=C(c4ccccc4)Sc4ccccc43)C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CCO,728.0
CCCC[Si](C)(C)c1cccc2ccccc12,C1CCCCC1,294.0
CCCC[n+]1c(/C=C2/C(=O)C(O)=C2[O-])ccc2ccccc21,CCO,465.0
CCCC[n+]1c(/C=C2/C(=O)C(O)=C2[O-])sc2ccccc21,CCO,446.0
CCCCc1c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)sc(-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)s2)c1CCCC,ClC(Cl)Cl,477.0
CCCCc1c(-c2ccc(/C=C(/C#N)C(=O)O)s2)sc(-c2cc3sc4cc(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)sc4c3s2)c1CCCC,ClC(Cl)Cl,465.0
CCCCc1c2c(nc3ccccc13)-c1cc3c(cc1CC2)-c1nc2ccccc2c(CCCC)c1CC3,ClC(Cl)Cl,372.0
CCCCc1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2c(CCCC)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc12,C1CCOC1,475.0
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,C1CCCCC1,400.3891783
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,C1CCOC1,398.4905179
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,C1COCCO1,397.0696262
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CC#N,397.0696262
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CC(C)CC(C)(C)C,398.4905179
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CC(C)O,396.1305963
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CC(O)CO,398.4905179
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CC1CCCCC1,399.4391874
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CC1COC(=O)O1,399.9104201
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CCCCCO,397.5495049
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CCCCO,472.0432392
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CCOC(C)=O,401.8097511
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CN(C)C=O,398.0194552
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CNC=O,398.9706557
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CO,395.6494388
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,COCCOC,397.5495049
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,CS(C)=O,396.1305963
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,ClC(Cl)Cl,397.0696262
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,N#Cc1ccccc1,401.2969919
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,NC=O,400.3891783
CCCCc1c2ccccc2c(-c2ccc(-c3nc4cc(CC(NC(=O)OC(C)(C)C)C(=O)OC)ccc4o3)cc2)c2ccccc12,OC(C(F)(F)F)C(F)(F)F,391.8694918
CCCCc1cc(-c2cccc(COC)c2)oc1-c1cccc(-c2cc(CCCC)c(-c3cccc(-c4cc(CCCC)c(-c5cccc(-c6oc(-c7cccc(-c8oc(-c9cccc(-c%10oc(-c%11cccc(COC)c%11)cc%10CCCC)c9)cc8CCCC)c7)cc6CCCC)c5)o4)c3)o2)c1,ClC(Cl)Cl,337.0
CCCCc1cc(-c2cccc(COC)c2)oc1-c1cccc(-c2oc(-c3cccc(COC)c3)cc2CCCC)c1,ClC(Cl)Cl,334.0
CCCCc1cc(-c2cccc(COC)c2)oc1-c1cccc(COC)c1,ClC(Cl)Cl,326.0
CCCCc1cc(-c2ccncc2)c2ccc3c(CCCC)cc(-c4ccncc4)c4ccc1c2c34,Cc1ccccc1,372.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,C1CCOC1,415.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CC#N,414.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CC(C)=O,414.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CCCCCC,411.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CCO,413.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CO,413.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CS(C)=O,418.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,Cc1ccccc1,417.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,ClC(Cl)Cl,421.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,ClCCl,419.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,OCC(F)(F)F,425.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,C1CCOC1,432.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,CC#N,434.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,CCCCCC,425.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,CCO,435.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,CN(C)C=O,437.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,CO,434.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,Cc1ccccc1,434.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,ClC(Cl)Cl,442.0
CCCCc1cc(C=O)c2ccc3c(CCCC)cc(N4CCCCC4)c4ccc1c2c34,ClCCl,440.0
CCCCc1cc(CCCC)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c43,CCCCCC,359.0
CCCCc1cc(CCCC)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c43,CO,358.0
CCCCc1cc(CCCC)c2ccc3c(CCCC)cc(CCCC)c4ccc1c2c43,ClCCl,361.0
CCCCc1cc2c3c(c1)-c1ccccc1B(c1c(C)cc(C)cc1C)N3B(c1c(C)cc(C)cc1C)c1ccccc1-2,ClCCl,366.0
CCCCc1cc2cccc3cc(CCCC)c4cc(-c5cc6[b-]7c(c5)c(CCCC)cc5cccc(cc6CCCC)[n+]75)cc1[b-]4[n+]23,C1CCCCC1,426.0
CCCCc1cc2cccc[n+]2[b-]2c(-c3cccc4[b-]3[n+]3ccccc3cc4CCCC)cccc21,C1CCCCC1,446.0
CCCCc1cc2cccc[n+]2[b-]2ccc(-c3cc[b-]4c(c3)c(CCCC)cc3cccc[n+]43)cc21,C1CCCCC1,512.0
CCCCc1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,CN(C)C=O,369.0
CCCCc1ccc(-n2c(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)nc3c4ccccc4c4ccccc4c32)cc1,CN(C)C=O,432.0
CCCCc1ccc(-n2c3c(c4c2c2c(n4-c4ccc(CCCC)cc4)-c4cc(F)ccc4NB2c2ccccc2)B(c2ccccc2)Nc2ccc(F)cc2-3)cc1,Cc1ccccc1,395.0
CCCCc1ccc(-n2c3c(c4c2c2c(n4-c4ccc(CCCC)cc4)-c4ccc(C(F)(F)F)cc4NB2c2ccccc2)B(c2ccccc2)Nc2cc(C(F)(F)F)ccc2-3)cc1,Cc1ccccc1,402.0
CCCCc1ccc(-n2c3c4cc(F)ccc4nnc3c3c2c2nnc4ccc(F)cc4c2n3-c2ccc(CCCC)cc2)cc1,Cc1ccccc1,315.0
CCCCc1ccc(-n2c3c4ccc(C(F)(F)F)cc4nc(-c4ccc(C#N)cc4)c3c3c2c2c(-c4ccc(C#N)cc4)nc4cc(C(F)(F)F)ccc4c2n3-c2ccc(CCCC)cc2)cc1,ClC(Cl)Cl,318.0
CCCCc1ccc(-n2c3c4ccc(C(F)(F)F)cc4nnc3c3c2c2nnc4cc(C(F)(F)F)ccc4c2n3-c2ccc(CCCC)cc2)cc1,Cc1ccccc1,322.0
CCCCc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(CCCC)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(CCCC)cc2)=C2/C=C(/C=C/C=C(C(=O)O)C(=O)O)C(=N2)/C=4c2ccc(CCCC)cc2)cc1,CN(C)C=O,611.0
CCCCc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,558.0
CCCCc1ccc(C#Cc2ccc3nc4ccc(C#Cc5ccc(CCCC)cc5)cn4c(=O)c3c2)cc1,ClCCl,383.0
CCCCc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,429.0
CCCCc1ccc(N(c2ccc(CCCC)cc2)c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C=C(C#N)C(=O)O)cc4)ccc2-3)cc1,ClCCl,418.0
CCCCc1ccc(N(c2ccc(CCCC)cc2)c2ccc3c(c2)Cc2cc(-c4ccc(C=C(C#N)C(=O)O)cc4)ccc2-3)cc1,ClCCl,405.0
CCCCc1ccc(N(c2ccc(CCCC)cc2)c2ccc3c(c2)S(=O)(=O)c2cc(N(c4ccc(CCCC)cc4)c4ccc(CCCC)cc4)ccc2-3)cc1,Cc1ccccc1,428.0
CCCCc1ccc(N(c2ccc(CCCC)cc2)c2ccc3c(c2)S(=O)(=O)c2cc(N(c4ccc(CCCC)cc4)c4ccc(CCCC)cc4)ccc2-3)cc1,ClC(Cl)Cl,436.0
CCCCc1ccc2c(c1)c1cc(CCCC)ccc1n2-c1ccc(S(=O)(=O)c2ccc(S(=O)(=O)c3ccc(-n4c5ccc(CCCC)cc5c5cc(CCCC)ccc54)cc3)cc2)cc1,Cc1ccccc1,355.0
CCCCc1ccc2c(c1)c1ccc3cccc4c3c1c1c2c2cccc3ccc5c6cc(CCCC)ccc6c4c1c5c32,ClCCl,492.0
CCCCc1ccc2cc3cc4ccccc4cc3cc2c1,ClCCl,446.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,C1CCOC1,396.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,CC#N,395.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,CC(C)=O,396.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,CCCCCC,393.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,CCO,396.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,CO,395.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,CS(C)=O,400.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,Cc1ccccc1,399.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,ClC(Cl)Cl,401.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,ClCCl,399.0
CCCCc1ccc2ccc3c(C=O)ccc4ccc1c2c43,OCC(F)(F)F,404.0
CCCCc1ccc2ccc3c(CCCC)cc(C(=O)CCC)c4ccc1c2c34,CO,390.0
CCCCc1ccc2ccc3c(CCCC)cc(C(=O)CCC)c4ccc1c2c34,ClCCl,391.0
CCCCc1ccc2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CCCCCC,352.0
CCCCc1ccc2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,CO,351.0
CCCCc1ccc2ccc3c(CCCC)cc(CCCC)c4ccc1c2c34,ClCCl,354.0
CCCCc1ccc2ccc3c(CCCC)ccc4ccc1c2c43,CCCCCC,344.0
CCCCc1ccc2ccc3c(CCCC)ccc4ccc1c2c43,CO,344.0
CCCCc1ccc2ccc3c(CCCC)ccc4ccc1c2c43,ClCCl,347.0
CCCCc1ccc2ccc3cccc4ccc1c2c34,CCCCCC,338.0
CCCCc1ccc2ccc3cccc4ccc1c2c34,CO,338.0
CCCCc1ccc2ccc3cccc4ccc1c2c34,ClCCl,341.0
CCCCc1coc2cc(O)c(OC)cc2c1=O,O,345.0
CCCCc1coc2cc(O)ccc2c1=O,O,334.0
CCCCn1/c(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2cccc3cccc1c32,CS(C)=O,672.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(-c5n(CCCC)c6cc(C)ccc6[n+]5CCCC)cc4)cc3)cc2)[n+](CCCC)c2ccc(C)cc21,O,304.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(-c5n(CCCC)c6ccccc6[n+]5CCCC)cc4)cc3)cc2)[n+](CCCC)c2ccccc21,O,303.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,C1CCOC1,425.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,CN(C)C=O,425.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,CO,425.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,Cc1ccccc1,425.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,ClCCl,425.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)nc2c3cccc4ccc5cccc(c5c43)c21,C1CCOC1,464.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)nc2c3cccc4ccc5cccc(c5c43)c21,CN(C)C=O,464.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)nc2c3cccc4ccc5cccc(c5c43)c21,CO,464.0
CCCCn1c(-c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)nc2c3cccc4ccc5cccc(c5c43)c21,ClCCl,464.0
CCCCn1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)nc2c(-c3cccs3)sc(-c3cccs3)c21,C1CCOC1,404.0
CCCCn1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,C1CCOC1,405.0
CCCCn1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,CC#N,405.0
CCCCn1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,CN(C)C=O,405.0
CCCCn1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,CO,405.0
CCCCn1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,Cc1ccccc1,405.0
CCCCn1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)nc2c3cccc4ccc5cccc(c5c43)c21,ClCCl,405.0
CCCCn1c(-c2ccc(-c3ccc(C(=O)OCC)cc3)s2)nc2c3cccnc3c3ncccc3c21,ClCCl,364.0
CCCCn1c(-c2ccc(-c3ccc(C=O)o3)s2)nc2c3cccnc3c3ncccc3c21,ClCCl,380.0
CCCCn1c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)nc2c3cccnc3c3ncccc3c21,ClCCl,386.0
CCCCn1c(-c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)s2)nc2c3cccnc3c3ncccc3c21,ClCCl,359.0
CCCCn1c(-c2ccc(-c3cccs3)s2)nc2c3cccnc3c3ncccc3c21,ClCCl,362.0
CCCCn1c(-c2ccc(-c3nnc(-c4ccc(-c5nc6c7ccccc7c7ccccc7c6n5CCCC)cc4)o3)cc2)nc2c3ccccc3c3ccccc3c21,ClCCl,366.0
CCCCn1c(-c2ccc(-c3nnc(-c4ccc5ccccc5c4)o3)cc2)nc(-c2ccccc2)c1-c1ccccc1,ClCCl,340.0
CCCCn1c(-c2ccc(-c3nnc(-c4ccc5ccccc5c4)o3)cc2)nc2c3ccccc3c3ccccc3c21,ClCCl,363.0
CCCCn1c(-c2ccc(-c3nnc(-c4ccccc4)o3)cc2)nc(-c2ccccc2)c1-c1ccccc1,ClCCl,339.0
CCCCn1c(-c2ccc(-c3nnc(-c4ccccc4)o3)cc2)nc2c3ccccc3c3ccccc3c21,ClCCl,363.0
CCCCn1c(-c2ccc(-c3nnc(-c4cccs4)o3)cc2)nc(-c2ccccc2)c1-c1ccccc1,ClCCl,340.0
CCCCn1c(-c2ccc(Br)s2)nc2c3cccnc3c3ncccc3c21,ClCCl,328.0
CCCCn1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc2c(-c3ccc(-c4ccc(/C=C(/C#N)C(=O)O)s4)s3)ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)c21,C1CCOC1,464.0
CCCCn1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc2c(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)c21,C1CCOC1,464.0
CCCCn1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc2c(-c3ccc(/C=C(\C#N)C(=O)O)cc3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)c21,C1CCOC1,365.0
CCCCn1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc2c(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c21,C1CCOC1,425.0
CCCCn1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)c21,C1CCOC1,418.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,C1CCOC1,451.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,CC#N,451.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,CN(C)C=O,451.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,CO,451.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,Cc1ccccc1,451.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,ClCCl,451.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,C1CCOC1,416.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,CC#N,416.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,CN(C)C=O,416.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,CO,416.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,Cc1ccccc1,416.0
CCCCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc2c3cccc4ccc5cccc(c5c43)c21,ClCCl,416.0
CCCCn1c(-c2cccs2)nc2c3cccnc3c3ncccc3c21,ClCCl,325.0
CCCCn1c(/C=C/c2ccc(/C=C(/C#N)C(=O)O)n2-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,CCO,437.0
CCCCn1c(/C=C/c2ccc(/C=C(\C#N)C(=O)O)n2-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,CCO,437.0
CCCCn1c(/C=C/c2ccccc2)nc2c(N(C)C)nc(N(C)C)nc21,ClCCl,395.0
CCCCn1c(=O)c2cc3ccc4cccc5ccc(c2c1=O)c3c45,ClC(Cl)Cl,427.0
CCCCn1c2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(C#N)cc2c2cc(C#N)cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c21,ClCCl,351.0
CCCCn1c2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(O)c(O)c6)s5)s4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,429.0
CCCCn1c2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,498.0
CCCCn1c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2c2ccc(N(c3ccc(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)cc3)c3ccc(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)cc3)cc21,ClCCl,488.0
CCCCn1c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)cc21,ClCCl,497.0
CCCCn1c2cc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)ccc2c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CCC)(CCC)c3ccccc3-4)cc21,ClCCl,490.0
CCCCn1c2cc(-c3ccc(-c4ccc5c(c4)C(CC)(CC)c4cc(/C=C(\C#N)C(=O)O)ccc4-5)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,420.0
CCCCn1c2cc(-c3ccc(-c4cccc(/C=C(\C#N)C(=O)O)c4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,448.0
CCCCn1c2cc(-c3ccc(-c4cccc(C=O)c4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,393.0
CCCCn1c2cc(-c3ccc(-c4cccnc4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,396.0
CCCCn1c2cc(-c3ccc(-c4ccncc4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,396.0
CCCCn1c2cc(-c3ccc(-c4cncc(-c5ccc(-c6ccc7c8ccc(N(c9ccccc9)c9ccccc9)cc8n(CCCC)c7c6)s5)c4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,388.0
CCCCn1c2cc(-c3ccc(-c4cnccn4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,402.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,C1CCOC1,443.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,CC#N,443.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,CCO,443.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,CN(C)C=O,443.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,Cc1ccccc1,443.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClC(Cl)Cl,443.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc43)cc21,ClCCl,443.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,C1CCOC1,440.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,CC#N,440.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,CCO,440.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,CN(C)C=O,440.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,Cc1ccccc1,440.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClC(Cl)Cl,440.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClCCl,440.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(N(c3ccc(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)cc3)c3ccc(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)cc3)cc21,ClCCl,500.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(N(c3ccccc3)c3ccc4c(c3)C(CCC)(CCC)c3ccccc3-4)cc21,ClCCl,483.0
CCCCn1c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,472.3333333333333
CCCCn1c2cc(-c3ccc(C(=O)O)cc3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,376.0
CCCCn1c2cc(-c3ccc(C4=C5C=CC(c6ccc(-c7ccncc7)s6)=[N+]5[B-](F)(F)n5c4ccc5-c4ccc(-c5ccncc5)s4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,673.0
CCCCn1c2cc(-c3ccc(C4=[N+]5C(=C(c6ccc(/C=C(\C#N)C(=O)O)s6)c6ccc(-c7ccc(-c8ccc9c%10ccc(N(c%11ccccc%11)c%11ccccc%11)cc%10n(CCCC)c9c8)s7)n6[B-]5(F)F)C=C4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,754.0
CCCCn1c2cc(-c3ccc(C4=[N+]5C(=C(c6ccc(/C=C(\C#N)c7ccncc7)s6)c6ccc(-c7ccc(-c8ccc9c%10ccc(N(c%11ccccc%11)c%11ccccc%11)cc%10n(CCCC)c9c8)s7)n6[B-]5(F)F)C=C4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,753.0
CCCCn1c2cc(-c3ccc(C4=[N+]5C(C=C4)C(c4ccc(/C=C(\C#N)C(=O)O)s4)c4ccc(-c6ccc(-c7ccc8c9ccc(N(c%10ccccc%10)c%10ccccc%10)cc9n(CCCC)c8c7)s6)n4[B-]5(F)F)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,754.0
CCCCn1c2cc(-c3ccc(C4=[N+]5C(C=C4)C(c4ccc(/C=C(\C#N)c6ccncc6)s4)c4ccc(-c6ccc(-c7ccc8c9ccc(N(c%10ccccc%10)c%10ccccc%10)cc9n(CCCC)c8c7)s6)n4[B-]5(F)F)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCOC1,753.0
CCCCn1c2cc(-c3cccs3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,375.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-c3ccc(-c4ccc5c6ccc(N(c7ccccc7)c7ccccc7)cc6n(CCCC)c5c4)s3)cc21,ClCCl,439.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,C1CCOC1,387.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,CC#N,387.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,CCO,387.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,CN(C)C=O,387.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,Cc1ccccc1,387.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClC(Cl)Cl,387.0
CCCCn1c2cc(/C=C(\C#N)C(=O)O)ccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClCCl,387.0
CCCCn1c2cc(C=C(C#N)C(=O)O)sc2c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClC(Cl)Cl,610.0
CCCCn1c2cc(C=C3C(=O)N(CC(C)CC)C(=O)C(C#N)=C3C)sc2c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClC(Cl)Cl,621.0
CCCCn1c2cc(C=O)ccc2c2ccc(-c3ccc(-c4ccc5c6ccc(N(c7ccccc7)c7ccccc7)cc6n(CCCC)c5c4)s3)cc21,ClCCl,410.0
CCCCn1c2ccc(-c3ccc(-c4ccc(O)c(O)c4)s3)cc2c2cc(-c3ccc(-c4ccc(O)c(O)c4)s3)ccc21,C1COCCO1,370.0
CCCCn1c2ccc(-c3ccc(-c4ccncc4)s3)cc2c2cc(-c3ccc(-c4ccc(C(=O)O)cc4)s3)ccc21,C1COCCO1,378.0
CCCCn1c2ccc(-c3ccc(-c4ccncc4)s3)cc2c2cc(-c3ccc(-c4ccc(O)c(O)c4)s3)ccc21,C1COCCO1,373.0
CCCCn1c2ccc(-c3ccc(-c4ccncc4)s3)cc2c2cc(-c3ccc(-c4ccncc4)s3)ccc21,C1CCOC1,378.0
CCCCn1c2ccc(-c3ccc(-c4ccncc4)s3)cc2c2cc(-c3ccc(-c4ccncc4)s3)ccc21,C1COCCO1,378.0
CCCCn1c2ccc(-c3ccc(-c4ccncc4)s3)cc2c2cc(N(c3ccccc3)c3ccccc3)ccc21,C1CCOC1,395.0
CCCCn1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2c2cc(-c3ccc(-c4ccc(OC)cc4)s3)ccc21,ClCCl,436.0
CCCCn1c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2c2nc3ccccc3nc21,C1CCOC1,396.0
CCCCn1c2ccc(-c3ccc(C(F)(F)F)cc3)cc2c2ccc3c4cc(-c5ccc(C(F)(F)F)cc5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,301.0
CCCCn1c2ccc(-c3ccc(C=O)cc3)cc2c2cc(-c3ccc(C=O)cc3)ccc21,C1CCOC1,358.0
CCCCn1c2ccc(-c3ccc(C=O)cc3)cc2c2cc(-c3ccc(C=O)cc3)ccc21,CC#N,359.0
CCCCn1c2ccc(-c3ccc(C=O)cc3)cc2c2cc(-c3ccc(C=O)cc3)ccc21,CC(C)=O,356.0
CCCCn1c2ccc(-c3ccc(C=O)cc3)cc2c2cc(-c3ccc(C=O)cc3)ccc21,CCCCCC,350.0
CCCCn1c2ccc(-c3ccc(C=O)cc3)cc2c2cc(-c3ccc(C=O)cc3)ccc21,CS(C)=O,368.0
CCCCn1c2ccc(-c3ccc(C=O)cc3)cc2c2cc(-c3ccc(C=O)cc3)ccc21,Cc1ccccc1,355.0
CCCCn1c2ccc(-c3ccc(O)c(O)c3)cc2c2cc(N(c3ccccc3)c3ccccc3)ccc21,C1CCOC1,364.0
CCCCn1c2ccc(-c3ccc(OC)cc3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClCCl,459.0
CCCCn1c2ccc(-c3ccc(OC)cc3)cc2c2ccc3c4cc(-c5ccc(OC)cc5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,338.0
CCCCn1c2ccc(-c3ccc4c(c3)c3c5c(ccc6ccc7ccccc7c65)ccc3n4CCCC)cc2c2c3c(ccc4ccc5ccccc5c43)ccc21,ClCCl,336.0
CCCCn1c2ccc(-c3ccc4c(c3)c3c5c(ccc6ccccc65)ccc3n4CCCC)cc2c2c3c(ccc4ccccc43)ccc21,ClCCl,313.0
CCCCn1c2ccc(-c3ccc4ccccc4c3)cc2c2ccc3c4cc(-c5ccc6ccccc6c5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,327.0
CCCCn1c2ccc(-c3cccc(F)c3)cc2c2ccc3c4cc(-c5cccc(F)c5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,318.0
CCCCn1c2ccc(-c3ccccc3)cc2c2ccc3c4cc(-c5ccccc5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,330.0
CCCCn1c2ccc(-c3cccs3)cc2c2c1c1c3ccc(-c4cccs4)cc3n(CCCC)c1c1c3ccc(-c4cccs4)cc3n(CCCC)c21,C1CCOC1,337.0
CCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2cc(-c3ccc(-c4ccc(OC)cc4)s3)ccc21,ClCCl,408.0
CCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2cc(-c3ccc(OC)cc3)ccc21,ClCCl,407.0
CCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2cc(/C=C(\C#N)C(=O)O)ccc21,ClCCl,398.0
CCCCn1c2ccc(/C=C(\C#N)C(=O)O)cc2c2nc3ccccc3nc21,C1CCOC1,355.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,C1CCOC1,410.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,CC#N,416.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,CCO,416.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,CCOC(C)=O,408.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,CN(C)C=O,423.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,ClCCl,417.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,O,434.0
CCCCn1c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2c2cc(Cn3c(-c4ccc5c(c4)c4ccccc4n5CCCC)nc4ccccc43)ccc21,c1ccccc1,409.0
CCCCn1c2ccc(/C=C3\SC(=O)NC3=O)cc2c2cc(/C=C3\SC(=O)NC3=O)ccc21,C1CCOC1,388.0
CCCCn1c2ccc(C#Cc3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2c2nc3ccccc3nc21,C1CCOC1,435.0
CCCCn1c2ccc(C#Cc3cccc(/C=C(\C#N)C(=O)O)c3)cc2c2nc3ccccc3nc21,C1CCOC1,412.0
CCCCn1c2ccc(C#N)cc2c2cc(C#N)ccc21,ClCCl,349.0
CCCCn1c2ccc(C=C3SC(=O)NC3=O)cc2c2cc(C=C3SC(=O)NC3=O)ccc21,C1CCOC1,388.0
CCCCn1c2ccc(C=CC(=O)O)cc2c2cc(C=CC3=CC(=C4C(=C(C#N)C#N)c5ccccc5S4(=O)=O)C=C(C=Cc4ccc5c(c4)c4cc(C=CC(=O)O)ccc4n5CC(C)CC)O3)ccc21,CN(C)C=O,598.0
CCCCn1c2ccc(C=CC(=O)O)cc2c2cc(C=CC3=CC(=C4C(=O)N(CC)C(=S)N(CC)C4=O)C=C(C=Cc4ccc5c(c4)c4cc(C=CC(=O)O)ccc4n5CC(C)CC)O3)ccc21,CN(C)C=O,510.0
CCCCn1c2ccc(C=CC(=O)O)cc2c2cc(C=CC3=CC(=C4C(=O)c5ccccc5C4=C(C#N)C#N)C=C(C=Cc4ccc5c(c4)c4cc(C=CC(=O)O)ccc4n5CC(C)CC)O3)ccc21,CN(C)C=O,583.0
CCCCn1c2ccc(N(c3ccc(/C=C(/C#N)C(=O)O)cc3)c3ccc(OC)cc3)cc2c2cc(N(c3ccc(/C=C(/C#N)C(=O)O)cc3)c3ccc(OC)cc3)ccc21,ClCCl,406.0
CCCCn1c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc(OC)cc3)cc2c2cc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc(OC)cc3)ccc21,ClCCl,406.0
CCCCn1c2ccc(N(c3ccccc3)c3ccc(OC)cc3)cc2c2cc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc(OC)cc3)ccc21,ClCCl,424.0
CCCCn1c2ccc3ccc4ccccc4c3c2c2c3c(ccc4ccccc43)ccc21,ClCCl,337.0
CCCCn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1cc(-c2ccc(C=C(C#N)C(=O)O)cc2)ccc1n3CCCC,CO,536.0
CCCCn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1cc(-c2ccc(C=C(C#N)C(=O)O)s2)ccc1n3CCCC,CO,538.0
CCCCn1c2ccccc2c2c1c1c3ccccc3n(CCCC)c1c1c3ccccc3n(CCCC)c21,C1CCOC1,316.0
CCCCn1c2ccccc2c2cc(-c3cc(/C=C(/C#N)C(=O)O)c(-c4cc5cc6c7c(c5oc4=O)C(C)(C)CCN7CCC6(C)C)s3)ccc21,ClC(Cl)Cl,507.0
CCCCn1c2ccccc2c2cc(-c3ccc(-c4cc5c(s4)c4sc(/C=C(/C#N)C(=O)O)cc4n5-c4ccc5c(c4)C(CCCC)(CCCC)c4ccccc4-5)s3)ccc21,C1CCOC1,496.0
CCCCn1c2ccccc2c2cc(-c3ccc(-c4cc5c(s4)c4sc(/C=C(\C#N)C(=O)O)cc4n5-c4ccc5c(c4)C(CCCC)(CCCC)c4ccccc4-5)s3)ccc21,C1CCOC1,496.0
CCCCn1c2ccccc2c2cc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5cc(-c7ccc8c(c7)c7cc(-c9sc(/C=C(\C#N)C(=O)O)c%10c9OCCO%10)ccc7n8CCCC)ccc5n6CCCC)ccc3n4CCCC)ccc21,C1CCOC1,456.0
CCCCn1c2ccccc2c2cc(-c3ccc4c(c3)c3cc(-c5ccc6c(c5)c5cc(-c7sc(/C=C(\C#N)C(=O)O)c8c7OCCO8)ccc5n6CCCC)ccc3n4CCCC)ccc21,C1CCOC1,444.0
CCCCn1c2ccccc2c2cc(-c3ccc4c(c3)c3cc(-c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)ccc3n4CCCC)ccc21,C1CCOC1,448.0
CCCCn1c2ccccc2c2cc(C#Cc3ccc4ccc5cccc6ccc3c4c56)ccc21,ClCCl,402.0
CCCCn1c2ccccc2c2cc(C=C3C(=O)NC(=O)NC3=O)ccc21,C1CCOC1,427.0
CCCCn1c2ccccc2c2cc(N3c4ccccc4Sc4cc(/C=C(\C#N)C(=O)O)ccc43)ccc21,ClCCl,478.0
CCCCn1c2ccccc2c2cc(N3c4ccccc4Sc4cc(/C=C5\SC(=S)N(CC(=O)O)C5=O)ccc43)ccc21,ClCCl,501.0
CCCCn1c2ccccc2c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc21,ClCCl,404.0
CCCCn1c2ccccc2c2ccc3c4cc(-c5ccc(C(F)(F)F)cc5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,326.0
CCCCn1c2ccccc2c2ccc3c4cc(-c5ccc(OC)cc5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,333.0
CCCCn1c2ccccc2c2ccc3c4cc(-c5ccc6ccccc6c5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,332.0
CCCCn1c2ccccc2c2ccc3c4cc(-c5cccc(F)c5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,328.0
CCCCn1c2ccccc2c2ccc3c4cc(-c5ccccc5)ccc4n(CCCC)c3c21,ClC(Cl)Cl,330.0
CCCCn1cc(/C=C/c2cc(=O)oc3cc(C)ccc23)c2ccccc21,CS(C)=O,414.0
CCCCn1cc(/C=C/c2cc(=O)oc3cc(C)ccc23)c2ccccc21,ClC(Cl)Cl,398.0
CCCN(/N=C/c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1,ClC(Cl)Cl,497.0
CCCN(/N=C/c1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc1,ClC(Cl)Cl,505.0
CCCN(CCC)C(=O)CNc1c(-c2ccc(C)cc2O)nc2cc(C(=O)OC)ccn12,CS(C)=O,390.0
CCCN(CCC)C(=O)CNc1c(-c2ccc(C)o2)nc2cc(C(=O)OC)ccn12,CS(C)=O,391.0
CCCN(CCC)C(=O)CNc1c(/C=C/c2ccc(OC)cc2)nc2cc(C(=O)OC)ccn12,CS(C)=O,413.0
CCCN(CCC)CCC,CCCCCC,199.0
CCCN(CCC)c1c(F)cc2c(c1F)OC1=C(/C=C/C3=[N+](C)c4ccccc4C3(C)C)CCCC1=C2,CCO,622.0
CCCN(CCC)c1c(F)cc2c(c1F)OC1=C(/C=C/C3=[N+](C)c4ccccc4C3(C)C)CCCC1=C2,ClC(Cl)Cl,696.0
CCCN(CCC)c1ccc(-c2c3c(n4ccc(C(C)=O)cc24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,445.0
CCCN(CCC)c1ccc(-c2nc3c4ccc(OCc5ccccc5)cc4c4cccc2n43)cc1,CO,339.0
CCCN(CCC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(Cl)cc1C3,CCO,540.0
CCCN(CCC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(N)cc1C3,O,564.0
CCCN(N=Cc1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1)c1ccc(C=C2SC(=S)N(CC(=O)O)C2=O)cc1,ClC(Cl)Cl,495.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2cc[n+](C)cc2)C(C)(C)c2ccccc21,CO,627.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2cc[n+](C)cc2)C(C)(C)c2ccccc21,CS(C)=O,637.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2cc[n+](C)cc2)C(C)(C)c2ccccc21,O,626.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2ccc([N+](=O)[O-])cc2)C(C)(C)c2ccccc21,CO,635.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2ccc([N+](=O)[O-])cc2)C(C)(C)c2ccccc21,CS(C)=O,643.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2ccc([N+](=O)[O-])cc2)C(C)(C)c2ccccc21,O,635.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2ccc3ccccc3n2)C(C)(C)c2ccccc21,CO,629.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2ccc3ccccc3n2)C(C)(C)c2ccccc21,CS(C)=O,641.0
CCCN1/C(=C/C=C(/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)c2ccc3ccccc3n2)C(C)(C)c2ccccc21,O,633.0
CCCN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2CCC)c2ccc([N+](=O)[O-])cc2)C(C)(C)c2ccccc21,CO,634.0
CCCN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2CCC)c2ccc([N+](=O)[O-])cc2)C(C)(C)c2ccccc21,CS(C)=O,643.0
CCCN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2CCC)c2ccc([N+](=O)[O-])cc2)C(C)(C)c2ccccc21,O,631.0
CCCN1/C(=C/C=C/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CO,637.0
CCCN1/C(=C/C=C/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CS(C)=O,645.0
CCCN1/C(=C/C=C/C=C/C2=[N+](CCC)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,O,633.0
CCCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,C1CCCCC1,358.0
CCCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,Cc1ccccc1,362.0
CCCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,ClCCl,509.0
CCCN1c2ccc(C#CC3=C4C=CC=[N+]4[B-](F)(F)n4cccc43)cc2Sc2cc(C#CC3=C4C=CC=[N+]4[B-](F)(F)n4cccc43)ccc21,ClCCl,542.0
CCCN1c2ccc(C3=C4C=CC=[N+]4[B-](F)(F)n4cccc43)cc2Sc2cc(C3=C4C=CC=[N+]4[B-](F)(F)n4cccc43)ccc21,ClCCl,500.0
CCCN1c2ccccc2Sc2cc(/C=C\c3cc(=O)oc4cc(NC(=O)OCC)ccc34)ccc21,ClC(Cl)Cl,422.0
CCCN1c2ccccc2Sc2cc(/C=C\c3cc(=O)oc4ccc(C)cc34)ccc21,ClC(Cl)Cl,423.0
CCCN1c2ccccc2Sc2cc(/C=C\c3cc(=O)oc4ccccc34)ccc21,ClC(Cl)Cl,424.0
CCCN1c2ccccc2Sc2cc(C#CC3=C4C=CC=[N+]4[B-](F)(F)n4cccc43)ccc21,ClCCl,540.0
CCCN1c2ccccc2Sc2cc(C3=C4C=CC=[N+]4[B-](F)(F)n4cccc43)ccc21,ClCCl,499.0
CCCN1c2ccccc2Sc2cc(C=Cc3cc(=O)oc4c(O)c(O)ccc34)ccc21,ClC(Cl)Cl,427.0
CCCN1c2ccccc2Sc2cc(C=Cc3cc(=O)oc4cc(C)ccc34)ccc21,ClC(Cl)Cl,424.0
CCCN1c2ccccc2Sc2cc(C=Cc3cc(=O)oc4cc(O)ccc34)ccc21,ClC(Cl)Cl,422.0
CCCN1c2ccccc2Sc2cc(C=Cc3cc(=O)oc4ccc(C)cc34)ccc21,ClC(Cl)Cl,423.0
CCCN1c2ccccc2Sc2cc(C=Cc3cc(=O)oc4ccccc34)ccc21,ClC(Cl)Cl,424.0
CCCNc1ccc(C2=c3cc4c(cc3OC2=O)=C(c2ccccc2)C(=O)O4)cc1,CN(C)C=O,652.0
CCCNc1ccc([N+](=O)[O-])c2c1=NC1(CCCCC1)N=2,CCO,546.0
CCCNc1ccc([N+](=O)[O-])c2n[nH]nc12,CCO,420.0
CCCNc1ccc([N+](=O)[O-])c2nonc12,CCO,486.0
CCCNc1ccc([N+](=O)[O-])c2nsnc12,CCO,476.0
CCCOC(=O)c1ccccc1C(=O)OCCC,CC#N,330.0
CCCOC(=O)c1ccnc(C(=O)OCCC)c1,CC#N,433.0
CCCOC(=O)c1ccncc1C(=O)OCCC,CC#N,396.0
CCCOC1Cc2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc2N(c2ccccc2)C1,C1CCOC1,472.0
CCCOC1Cc2cc(/C=N/N(c3ccccc3)c3ccc(C=C(C#N)C(=O)O)cc3)ccc2N(c2ccccc2)C1,C1CCOC1,425.0
CCCOC1Cc2cc(/C=N/N(c3ccccc3)c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)ccc2N(c2ccccc2)C1,C1CCOC1,469.0
CCCOc1c2cc(C(C)(C)C)cc1Cc1cc(C(C)(C)C)cc(c1OCCC)Cc1cc(C(C)(C)C)cc(c1OCCCCC(=O)COc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc(N(c3ccccc3)c3ccccc3)cc1)Cc1cc(C(C)(C)C)cc(c1OCCC)C2,ClCCl,456.0
CCCOc1c2cc(C(C)(C)C)cc1Cc1cc(C(C)(C)C)cc(c1OCCCCC(=O)COc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc(N(c3ccccc3)c3ccccc3)cc1)Cc1cc(C(C)(C)C)cc(c1OCCC)Cc1cc(C(C)(C)C)cc(c1OCCCCCC(=O)COc1cc(/C=C(/C#N)C(=O)O)sc1-c1ccc(N(c3ccccc3)c3ccccc3)cc1)C2,ClCCl,451.0
CCCOc1cc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c(OCCC)cc1C=C(C#N)C(=O)O,ClCCl,462.0
CCCOc1cc(-c2ccccn2)nc(-c2ccccn2)c1,CC#N,277.0
CCCOc1cc2c(C(C)(C)C)c(c1)Cc1cc(OCCCCC(=O)OCc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)c5nsnc45)sc3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(c1C(C)(C)C)Cc1cc(OCCC)cc(c1C(C)(C)C)Cc1cc(OCCCCC(=O)OCc3cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)c5nsnc45)sc3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(c1C(C)(C)C)C2,C1CCOC1,464.0
CCCOc1cc2c(C(C)(C)C)c(c1)Cc1cc(OCCCCC(=O)OCc3cc(/C=C(\C#N)C(=O)O)sc3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(c1C(C)(C)C)Cc1cc(OCCC)cc(c1C(C)(C)C)Cc1cc(OCCCCC(=O)OCc3cc(C=C(C#N)C(=O)O)sc3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(c1C(C)(C)C)C2,C1CCOC1,425.0
CCCOc1cc2c(C(C)(C)C)c(c1)Cc1cc(OCCCCC(=O)OCc3cc(/C=C(\C#N)C(=O)O)sc3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(c1C(C)(C)C)Cc1cc(OCCC)cc(c1C(C)(C)C)Cc1cc(OCCCCC(=O)OCc3cc(C=C(C#N)C(=O)O)sc3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(c1C(C)(C)C)C2,ClCCl,451.0
CCCOc1cc2c(C(C)(C)C)c(c1)Cc1cc(OCCCCC(=O)OCc3cc(/C=C(\C#N)C(=O)O)sc3-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(c1C(C)(C)C)Cc1cc(OCCC)cc(c1C(C)(C)C)Cc1cc(OCCCCC(=O)OCc3cc(C=C(C#N)C(=O)O)sc3C=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)cc(c1C(C)(C)C)C2,ClCCl,557.0
CCCOc1cc2c(C(C)(C)C)c(c1)Cc1cc(OCCCCC(=O)OCc3cc(/C=C(\C#N)C(=O)O)sc3C=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)cc(c1C(C)(C)C)Cc1cc(OCCC)cc(c1C(C)(C)C)Cc1cc(OCCCCC(=O)OCc3cc(C=C(C#N)C(=O)O)sc3C=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)cc(c1C(C)(C)C)C2,ClCCl,533.0
CCCOc1cc2c(cc1C=C(c1ccccc1)c1ccccc1)c1cc(C=C(c3ccccc3)c3ccccc3)ccc1n2CCC,C1CCOC1,474.0
CCCOc1ccc(-c2ccc(N(c3ccc(-c4cc(COCCC[C@H](C)[C@@H]5CC[C@@H]6[C@H]7[C@@H](O)CC8C[C@@H](O)CC[C@@]8(C)[C@@H]7CC[C@@]56C)c(-c5ccc(/C=C(\C#N)C(=O)O)o5)s4)cc3)c3ccc(-c4ccc(OCCC)cc4OCCC)cc3)cc2)c(OCCC)c1,ClCCl,492.0
CCCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CC#N,413.0
CCCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CC1CCCCC1,414.0
CCCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,Cc1ccccc1,420.0
CCCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,ClCCl,421.0
CCCOc1ccc(C=CC(=C=O)CC(C=Cc2ccc(OCCC)c(OC)c2)OCCC)cc1OC,CS(C)=O,506.0
CCCSC(=O)c1ccc(C(=O)SCCC)cc1,CC#N,625.0
CCCSC(=O)c1ccc(C(=O)SCCC)nc1,CC#N,613.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1,CC#N,574.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1,CCCCCC,577.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1,CCOC(C)=O,575.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1,CO,574.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1,ClCCl,579.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1SC#N,CC#N,536.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1SC#N,CCCCCC,556.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1SC#N,CCOC(C)=O,545.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1SC#N,CO,536.0
CCCSC1=[N+]2C(=C(c3ccccc3)c3ccc(SCCC)n3[B-]2(F)F)C=C1SC#N,ClCCl,545.0
CCCSc1cc(-c2ccccn2)nc(-c2cc(SCCC)cc(-c3cc(SCCC)cc(-c4cccc(-c5cc(SCCC)cc(-c6cc(SCCC)cc(-c7cc(SCCC)cc(-c8ccccn8)n7)n6)n5)n4)n3)n2)c1,CC#N,266.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CC#N,538.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CCCCCC,555.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CCOC(C)=O,549.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CO,544.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,ClCCl,552.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CC#N,531.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CCCCCC,536.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CCOC(C)=O,534.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CO,536.0
CCCSc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,ClCCl,537.0
CCC[Si](CCC)(CCC)c1cc2ccc3cccc4ccc(c1C(=O)NC(C)(C)C)c2c34,ClC(Cl)Cl,382.0
CCCc1[o+]c2c(CCC)c(CCC)c3cc4cccc5ccc6cc(c1CCC)c2c3c6c54,ClCCl,582.0
CCCc1c(/C=C(\C#N)C(=O)O)sc2cc(-c3ccc4c(c3)C3CCCC3N4c3ccc(OC(C)(C)C)cc3)sc12,ClCCl,465.0
CCCc1c(/C=C(\C#N)C(=O)O)sc2cc(-c3ccc4c(c3)C3CCCC3N4c3ccc4c(c3)C(CCC)(CCC)c3c5c(c6c(c3-4)C(CCC)(CCC)c3ccccc3-6)C(CCC)(CCC)c3ccccc3-5)sc12,ClCCl,500.0
CCCc1c(/C=C(\C#N)C(=O)O)sc2cc(-c3ccc4c(c3)C3CCCC3N4c3ccc4c(c3)C(CCC)(CCC)c3ccccc3-4)sc12,ClCCl,492.0
CCCc1c(/C=C(\C#N)C(=O)O)sc2cc(-c3ccc4c(c3)[C@@H]3CCC[C@@H]3N4c3ccc(OC(C)(C)C)cc3)sc12,ClCCl,465.0
CCCc1c(/C=C(\C#N)C(=O)O)sc2cc(-c3ccc4c(c3)[C@@H]3CCC[C@@H]3N4c3ccc4c(c3)C(CCC)(CCC)c3c5c(c6c(c3-4)C(CCC)(CCC)c3ccccc3-6)C(CCC)(CCC)c3ccccc3-5)sc12,ClCCl,500.0
CCCc1c(/C=C(\C#N)C(=O)O)sc2cc(-c3ccc4c(c3)[C@@H]3CCC[C@@H]3N4c3ccc4c(c3)C(CCC)(CCC)c3ccccc3-4)sc12,ClCCl,492.0
CCCc1c(C(=O)c2ccc3c4c(cccc24)-c2cccc4c2C3CC=C4)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,468.0
CCCc1c(CCC)c(CCC)n2c(c1CCC)c(C=O)c1cc(Br)ccc12,CC#N,406.0
CCCc1c(CCC)c(CCC)n2c(c1CCC)c(C=O)c1cc(Br)ccc12,CS(C)=O,409.0
CCCc1c(CCC)c(CCC)n2c(c1CCC)c(C=O)c1ccccc12,CC#N,408.0
CCCc1c(CCC)c(CCC)n2c(c1CCC)c(C=O)c1ccccc12,CS(C)=O,410.0
CCCc1cc2c(s1)-c1cc3c(cc1NB2c1ccccc1)-c1sc(CCC)cc1B(c1ccccc1)N3,ClCCl,411.0
CCCc1cc2c3[o+]c(CCC)c(CCC)c4cccc(c5cccc(c1CCC)c52)c43,ClCCl,608.0
CCCc1cc2c3c(NC)ncnc3cc(CCC)n2n1,ClCCl,325.0
CCCc1cc2ncnc(NC)c2c2cc(C3CCCCC3)nn12,ClCCl,324.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3n(C)c3c4c(ccc23)NC(C)(C)C=C4C)cc1,O,500.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)cc1,O,485.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(C)C)ccc23)cc1,O,525.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(CC)CCCN(C)C)ccc23)cc1,O,525.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N)ccc23)cc1,O,500.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)cc1,O,530.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(O)ccc23)cc1,O,495.0
CCCc1ccc(-c2c3ccc(=[NH2+])cc-3sc3cc(N)ccc23)cc1,O,520.0
CCCc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,558.0
CCCc1ccc(C#Cc2cc(C#Cc3ccc(CCC)cc3)c3ccc4c(C#Cc5ccc(CCC)cc5)cc(C#Cc5ccc(CCC)cc5)c5ccc2c3c54)cc1,ClCCl,470.0
CCCc1ccc(C#Cc2cc(C#Cc3ccc(CCC)cc3)c3ccc4c(C#Cc5ccc(N(C)C)cc5)cc(C#Cc5ccc(CCC)cc5)c5ccc2c3c54)cc1,ClCCl,473.0
CCCc1ccc(C#Cc2cc(C#Cc3ccc(N(C)C)cc3)c3ccc4c(C#Cc5ccc(N(C)C)cc5)cc(C#Cc5ccc(CCC)cc5)c5ccc2c3c54)cc1,ClCCl,488.0
CCCc1ccc(C#Cc2cc(C#Cc3ccc(N(C)C)cc3)c3ccc4c(C#Cc5ccc(N(C)C)cc5)cc(C#Cc5ccc(N(C)C)cc5)c5ccc2c3c54)cc1,ClCCl,508.0
CCCc1ccc(C#Cc2ccc3nc4ccc(C#Cc5ccc(CCC)cc5)cn4c(=O)c3c2)cc1,ClCCl,384.0
CCCc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,428.0
CCCn1c(-c2cc(-c3nc4ccccc4n3CCC)cc(-c3nc4ccccc4n3CCC)c2)nc2ccccc21,CS(C)=O,301.5
CCCn1c(=O)c(/C=C/c2nc3ccc(C)cc3n(CCC)c2=O)nc2ccc(C)cc21,C1COCCO1,434.0
CCCn1c(=O)c(/C=C/c2nc3ccc(C)cc3n(CCC)c2=O)nc2ccc(C)cc21,CC#N,431.0
CCCn1c(=O)c(/C=C/c2nc3ccc(C)cc3n(CCC)c2=O)nc2ccc(C)cc21,ClCCl,434.0
CCCn1c(C)ccc1-c1cc(-c2c(C)cccc2C(=O)[O-])cc(-c2ccc(C)n2CCC)c1,CC1CCCCC1,298.0
CCCn1c(N=Nc2ccc3ncsc3c2)ccc1-c1cccs1,CS(C)=O,464.0
CCCn1c(N=Nc2nc3ccc(C)cc3s2)ccc1-c1cccs1,CS(C)=O,520.0
CCCn1c(N=Nc2nc3ccccc3s2)ccc1-c1cccs1,CS(C)=O,519.0
CCCn1c(Nc2c(C)cccc2C)nc2cc3c(C)c(C(N)=O)c(=O)oc3cc21,CCO,341.0
CCCn1c2cccc3c2[c+]2c4c1cccc4n(CCC)c1cccc(c12)n3CCC,CC#N,521.0
CCCn1c2cccc3oc4cccc5c4[c+](c32)c2c1cccc2n5CCC,CC#N,557.0
CCCn1c2cccc3oc4cccc5c4[c+](c32)c2c1cccc2n5CCC,ClCCl,560.0
CCN(C(C)=O)c1cc2c(cc1C)C(c1ccccc1C(=O)O)=C1CCCC(/C=C/C3=[N+](C)c4ccc5ccccc5c4C3(C)C)=C1O2,CCO,678.0
CCN(C(C)=O)c1cc2c(cc1C)C(c1ccccc1C(=O)O)=C1CCCC(/C=C/C3=[N+](C)c4ccccc4C3(C)C)=C1O2,CCO,656.0
CCN(C)c1ccc(C2=C3C(C)=CC(/C=C/c4ccc(OCC(=O)OC)cc4)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CO,567.0
CCN(C)c1ccc(C2=C3C(C)=CC(/C=C/c4ccc(OCCCN=[N+]=[N-])cc4)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CO,568.0
CCN(C)c1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CO,500.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,C1CCOC1,472.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CCCCCC,444.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CCO,473.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CCOC(C)=O,463.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CN(C)C=O,479.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CO,472.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,Cc1ccccc1,461.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,ClC(Cl)(Cl)Cl,467.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,ClC(Cl)Cl,467.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,ClCCl,467.0
CCN(CC)/C(C)=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,c1ccccc1,462.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,C1CCOC1,360.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,C1COCCO1,362.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CC#N,363.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CC(C)=O,361.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CCCCCC,359.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CCO,362.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CN(C)C=O,371.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CO,362.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CS(C)=O,374.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,Cc1ccccc1,363.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,ClC(Cl)Cl,373.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,ClCCl,372.0
CCN(CC)C(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,OCC(F)(F)F,357.0
CCN(CC)C1=[N+]2C(=C(c3ccc(C)cc3)c3cccn3[B-]2(F)F)C=C1,ClCCl,473.0
CCN(CC)C1C=c2[o+]c(C(C)(C)C)cc(/C=C/C=C/C=C3\N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)c2=CC1,CCO,736.0
CCN(CC)Cc1ccc2c(Cl)ccc(OC)c2n1,CO,445.0
CCN(CC)Cc1ccc2cccc(O)c2n1,CO,438.0
CCN(CC)Cc1ccc2cccnc2c1O,CO,506.0
CCN(CC)Cc1ccc2cccnc2c1OC,CO,390.0
CCN(CC)c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,ClCCl,499.0
CCN(CC)c1cc(F)c(C(=O)c2cc(F)c(F)cc2F)cc1F,CCO,361.0
CCN(CC)c1cc(F)c(C(=O)c2cc(F)c(N(CC)CC)cc2F)cc1F,CCO,369.0
CCN(CC)c1cc(NC(C)=O)c(/N=N/c2cc3c(=O)[nH][nH]c(=O)c3cc2[N+](=O)[O-])cc1OC,CC(=O)O,556.0
CCN(CC)c1cc(NC(C)=O)c(/N=N/c2cc3c(=O)[nH][nH]c(=O)c3cc2[N+](=O)[O-])cc1OC,CN(C)C=O,550.0
CCN(CC)c1cc(NC(C)=O)c(/N=N/c2cc3c(=O)[nH][nH]c(=O)c3cc2[N+](=O)[O-])cc1OC,CS(C)=O,553.0
CCN(CC)c1cc2ccc3cc(C#N)cc4ccc(c1)c2c34,CCCCCC,437.0
CCN(CC)c1cc2ccc3cccc4ccc(c1)c2c34,CCCCCC,427.0
CCN(CC)c1cc2oc3cc(N(CC)CC)c(F)cc3c(=O)c2cc1F,CCO,389.0
CCN(CC)c1cc2sc3cc(N(CC)CC)c(F)cc3c(=O)c2cc1F,CCO,393.0
CCN(CC)c1ccc(-c2c3c(n4c2ccc2oc(-c5ccc(C#N)cc5)cc24)C(=O)N(CCCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,459.0
CCN(CC)c1ccc(-c2c3c(n4c2ccc2oc(-c5ccccc5)cc24)C(=O)N(CCCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,424.0
CCN(CC)c1ccc(-c2c3c(n4c2ccc2occc24)C(=O)N(CCCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,386.0
CCN(CC)c1ccc(-c2cc3c(ccc4c(-c5ccc(C#N)cc5)c5c(n43)C(=O)N(CCCNC(=O)OC(C)(C)C)C5)o2)cc1,ClCCl,431.0
CCN(CC)c1ccc(-c2cc3c(ccc4c(-c5ccccc5)c5c(n43)C(=O)N(CCCNC(=O)OC(C)(C)C)C5)o2)cc1,ClCCl,423.0
CCN(CC)c1ccc(-c2cc3c(ccc4cc5c(n43)C(=O)N(CCCNC(=O)OC(C)(C)C)C5)o2)cc1,ClCCl,405.0
CCN(CC)c1ccc(-c2cc3c(s2)=CC2=C(c4ccc(C(=O)O)cc4)c4cc5sc(-c6ccc(N(CC)CC)cc6)cc5n4[B-](F)(F)[N+]=32)cc1,ClCCl,783.0
CCN(CC)c1ccc(-c2cc3c(s2)=CC2=C(c4ccc(C(=O)O)s4)c4cc5sc(-c6ccc(N(CC)CC)cc6)cc5n4[B-](F)(F)[N+]=32)cc1,ClCCl,812.0
CCN(CC)c1ccc(-c2ccc(-c3nc(C#N)c4ccccc4n3)s2)cc1,CC#N,397.0
CCN(CC)c1ccc(-c2ccc(-c3nc(C#N)c4ccccc4n3)s2)cc1,Cc1ccccc1,402.0
CCN(CC)c1ccc(-c2ccc(-c3nc(N4CCOCC4)c4ccccc4n3)s2)cc1,CC#N,401.0
CCN(CC)c1ccc(-c2ccc(-c3nc(N4CCOCC4)c4ccccc4n3)s2)cc1,Cc1ccccc1,405.0
CCN(CC)c1ccc(-c2ccc(-c3nc4ccccc4c(=O)[nH]3)s2)cc1,CC#N,404.0
CCN(CC)c1ccc(-c2ccc(-c3nc4ccccc4c(=O)[nH]3)s2)cc1,Cc1ccccc1,410.0
CCN(CC)c1ccc(-c2nc(Oc3ccc(-c4nc5cc([N+](=O)[O-])ccc5[nH]4)cc3)nc(Oc3ccc(-c4nc5cc([N+](=O)[O-])ccc5[nH]4)cc3)n2)cc1,CN(C)C=O,383.0
CCN(CC)c1ccc(-c2nc(Oc3ccc(-c4nc5ccccc5[nH]4)cc3)nc(Oc3ccc(-c4nc5ccccc5[nH]4)cc3)n2)cc1,CN(C)C=O,376.0
CCN(CC)c1ccc(-c2nc(Oc3ccc(-c4nc5ccccc5s4)cc3)nc(Oc3ccc(-c4nc5ccccc5s4)cc3)n2)cc1,CN(C)C=O,374.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1,ClC(Cl)Cl,444.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,C1CCOC1,364.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CC#N,360.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CCCCCC,369.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CCOC(C)=O,358.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CO,360.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CS(C)=O,375.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,Cc1ccccc1,368.0
CCN(CC)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,ClCCl,363.0
CCN(CC)c1ccc(-c2nc3c(nc2-c2ccc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)cc2)c2ccccc2n3C)cc1,C1CCOC1,405.0
CCN(CC)c1ccc(-c2nc3c(nc2-c2ccc([B-](F)(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)cc2)c2ccccc2n3C)cc1,C1CCOC1,414.7495362
CCN(CC)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)c(O)c1,C1CCOC1,362.0
CCN(CC)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)c(O)c1,CC#N,363.0
CCN(CC)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)c(O)c1,CCCCCC,361.0
CCN(CC)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)c(O)c1,CO,359.0
CCN(CC)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)c(O)c1,CS(C)=O,365.0
CCN(CC)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)c(O)c1,Cc1ccccc1,367.0
CCN(CC)c1ccc(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)c(O)c1,ClCCl,370.0
CCN(CC)c1ccc(-c2nc3c4ccccc4n(C)c3nc2-c2ccc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)cc2)cc1,C1CCOC1,416.0
CCN(CC)c1ccc(-c2nc3cc(C(NC(=O)OC(C)(C)C)C(=O)OC)ccc3o2)c(O)c1,CC#N,364.0
CCN(CC)c1ccc(-c2nc3cc(C(NC(=O)OC(C)(C)C)C(=O)OC)ccc3o2)c(O)c1,CC1CCCCC1,364.0
CCN(CC)c1ccc(-c2nc3cc(C(NC(=O)OC(C)(C)C)C(=O)OC)ccc3o2)c(O)c1,CO,364.0
CCN(CC)c1ccc(-c2nc3ccc(-n4nc5ccc6ccc(S(=O)(=O)O)cc6c5n4)cc3[nH]2)c(O)c1,CS(C)=O,379.0
CCN(CC)c1ccc(-c2nc3ccc(-n4nc5ccc6cccc(S(=O)(=O)O)c6c5n4)cc3[nH]2)c(O)c1,CS(C)=O,503.0
CCN(CC)c1ccc(-c2nc3ccc(-n4nc5ccc6ccccc6c5n4)cc3[nH]2)c(O)c1,CS(C)=O,385.0
CCN(CC)c1ccc(-c2nc3ncccc3o2)c(O)c1,CO,379.0
CCN(CC)c1ccc(-c2oc3cc(N=C=S)ccc3c(=O)c2O)cc1,CCO,607.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2O)cc1,CC#N,574.5
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,Brc1ccccc1,393.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,C1CCOC1,386.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,C1COCCO1,383.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CC#N,389.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CC(C)=O,388.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CC(C)O,398.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CC(C)OC(C)C,378.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCC(C)(C)O,392.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCCCCC,371.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCCCCCCCO,400.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCCCO,400.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCCCOCCCC,381.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCN(CC)CC,376.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCO,400.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CCOC(C)=O,384.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CN(C)C=O,394.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CO,402.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,CS(C)=O,398.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,Cc1ccccc1,384.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,ClC(Cl)(Cl)Cl,382.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,ClC(Cl)Cl,394.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,ClCCl,393.0
CCN(CC)c1ccc(-c2oc3ccccc3c(=O)c2OC)cc1,O,413.0
CCN(CC)c1ccc(-n2c(C)ccc2C)cc1,CC#N,304.0
CCN(CC)c1ccc(-n2c(C)ccc2C)cc1,CCCCCC,310.0
CCN(CC)c1ccc(-n2cccc2)cc1,CC#N,280.0
CCN(CC)c1ccc(-n2cccc2)cc1,CCCCCC,276.0
CCN(CC)c1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,CC#N,476.0
CCN(CC)c1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,CCCO,468.0
CCN(CC)c1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,CCO,488.0
CCN(CC)c1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,CCOC(C)=O,472.0
CCN(CC)c1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,Cc1ccccc1,471.0
CCN(CC)c1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,ClCCl,480.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,C1CCCCC1,542.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,C1COCCO1,569.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,CC#N,589.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,CC(C)=O,584.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,CCO,581.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,CCOC(C)=O,571.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,CO,582.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,CS(C)=O,607.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,Cc1ccccc1,567.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,ClC(Cl)Cl,581.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,ClCCl,587.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,OCC(O)CO,610.0
CCN(CC)c1ccc(/C=C/C2=[O+][B-](F)(F)Oc3c2c(=O)oc2cc(N(CC)CC)ccc32)cc1,OCCO,605.0
CCN(CC)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(CC)CC)cc3)nc(N)n2)cc1,Cc1ccccc1,418.0
CCN(CC)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(CC)CC)cc3)nc(N)n2)cc1,ClC(Cl)Cl,433.0
CCN(CC)c1ccc(/C=C/c2sc3ccccc3[n+]2CC(=O)[O-])cc1,CO,533.0
CCN(CC)c1ccc(/C=C/c2sc3ccccc3[n+]2CCC(=O)[O-])c(O)c1,CO,544.0
CCN(CC)c1ccc(/C=C/c2sc3ccccc3[n+]2CCC(=O)[O-])cc1,CO,536.0
CCN(CC)c1ccc(/C=C/c2sc3ccccc3[n+]2CCCS(=O)(=O)[O-])c(O)c1,CO,547.0
CCN(CC)c1ccc(/C=C2\CC/C(=C\c3ccc(N(c4ccccc4)c4ccccc4)cc3)C2=C(C#N)C#N)cc1,CN(C)C=O,579.0
CCN(CC)c1ccc(/C=C2\CCCc3c2[o+]c2cc(N(CC)CC)ccc2c3-c2ccccc2C(=O)O)c(O)c1,CO,699.0
CCN(CC)c1ccc(/C=C2\CCCc3c2[o+]c2cc(N(CC)CC)ccc2c3-c2ccccc2C(=O)O)cc1,CO,663.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,C1CCOC1,471.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,C1COCCO1,471.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,CC#N,484.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,CC(C)=O,482.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,CCO,480.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,CCOC(C)=O,473.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,CN(C)C=O,484.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,CS(C)=O,501.0
CCN(CC)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)c(O)c1,ClCCl,487.0
CCN(CC)c1ccc(/C=N/C(C#N)=C(C#N)/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CC#N,565.0
CCN(CC)c1ccc(/C=N/C(C#N)=C(C#N)/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CN(C)C=O,571.0
CCN(CC)c1ccc(/C=N/C(C#N)=C(C#N)/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,ClCCl,570.0
CCN(CC)c1ccc(/C=N/C(C#N)=C(C#N)\N=C\c2ccc(N(CC)CC)cc2O)c(O)c1,CC#N,564.0
CCN(CC)c1ccc(/C=N/CC/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CC#N,339.0
CCN(CC)c1ccc(/C=N/CC/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CN(C)C=O,353.0
CCN(CC)c1ccc(/C=N/CC/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,ClCCl,344.0
CCN(CC)c1ccc(/C=N/Nc2ccc(C#N)cc2)c(O)c1,CC#N,382.0
CCN(CC)c1ccc(/C=N/Nc2ccc(C#N)cc2)c(O)c1,CCCCCC,384.0
CCN(CC)c1ccc(/C=N/Nc2ccc(C#N)cc2)c(O)c1,CO,368.0
CCN(CC)c1ccc(/C=N/Nc2ccc(C#N)cc2)c(O)c1,CS(C)=O,391.0
CCN(CC)c1ccc(/C=N/Nc2ccc(C#N)cc2)c(O)c1,ClC(Cl)Cl,373.0
CCN(CC)c1ccc(/C=N/c2cc3nc4ccccc4nc3cc2/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CC#N,451.0
CCN(CC)c1ccc(/C=N/c2cc3nc4ccccc4nc3cc2/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CN(C)C=O,488.0
CCN(CC)c1ccc(/C=N/c2cc3nc4ccccc4nc3cc2/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,ClCCl,476.0
CCN(CC)c1ccc(/C=N/c2ccccc2/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CC#N,442.0
CCN(CC)c1ccc(/C=N/c2ccccc2/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,CN(C)C=O,490.0
CCN(CC)c1ccc(/C=N/c2ccccc2/N=C/c2ccc(N(CC)CC)cc2O)c(O)c1,ClCCl,442.0
CCN(CC)c1ccc(/N=N/c2cc3c(=O)[nH][nH]c(=O)c3cc2[N+](=O)[O-])c(NC(C)=O)c1,CC(=O)O,532.0
CCN(CC)c1ccc(/N=N/c2cc3c(=O)[nH][nH]c(=O)c3cc2[N+](=O)[O-])c(NC(C)=O)c1,CN(C)C=O,518.0
CCN(CC)c1ccc(/N=N/c2cc3c(=O)[nH][nH]c(=O)c3cc2[N+](=O)[O-])c(NC(C)=O)c1,CS(C)=O,519.0
CCN(CC)c1ccc(/N=N/c2ccc3c(=O)[nH][nH]c(=O)c3c2[N+](=O)[O-])c(NC(C)=O)c1,CC(=O)O,526.0
CCN(CC)c1ccc(/N=N/c2ccc3c(=O)[nH][nH]c(=O)c3c2[N+](=O)[O-])c(NC(C)=O)c1,CN(C)C=O,517.0
CCN(CC)c1ccc(/N=N/c2ccc3c(=O)[nH][nH]c(=O)c3c2[N+](=O)[O-])c(NC(C)=O)c1,CS(C)=O,523.0
CCN(CC)c1ccc(/N=N/c2nc3ccc(Br)cc3s2)cc1,CC#N,520.0
CCN(CC)c1ccc(/N=N/c2nc3ccc(Br)cc3s2)cc1,ClCCl,518.0
CCN(CC)c1ccc(/N=N/c2nc3ccc(OC)cc3s2)cc1,CC#N,515.0
CCN(CC)c1ccc(/N=N/c2nc3ccc(OC)cc3s2)cc1,ClCCl,517.0
CCN(CC)c1ccc(/N=N\c2ccc3c4c(cccc24)C(=O)N(c2ccc(S(=O)(=O)Nc4ncccn4)cc2)C3=O)c(C)c1,CN(C)C=O,555.0
CCN(CC)c1ccc(/N=N\c2ccc3c4c(cccc24)C(=O)OC3=O)c(C)c1,CN(C)C=O,432.0
CCN(CC)c1ccc(C(=C(c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(N(CC)CC)cc2)cc1,ClCCl,488.0
CCN(CC)c1ccc(C(=C(c2ccc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)cc2)c2ccc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)cc2)c2ccc(N(CC)CC)cc2)cc1,C1CCOC1,431.0
CCN(CC)c1ccc(C(=C(c2ccc(Br)cc2)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(N(CC)CC)cc2)cc1,ClCCl,502.0
CCN(CC)c1ccc(C(=O)NC(C)C)cc1,CC#N,307.0
CCN(CC)c1ccc(C(=O)Nc2ccc3c(c2)OCCOCCOCCOCCO3)cc1,N=C(NCCCCCCNC(=N)NC(=N)Nc1ccc(Cl)cc1)NC(=N)Nc1ccc(Cl)cc1,323.0
CCN(CC)c1ccc(C2=C3C(C)=CC(/C=C/c4ccc(OCC(=O)OC)cc4)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CO,567.0
CCN(CC)c1ccc(C2=C3C(C)=CC(/C=C/c4ccc(OCCCN=[N+]=[N-])cc4)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CO,570.0
CCN(CC)c1ccc(C=C(C#N)c2ccc(-c3nc4cc(C(=O)O)ccc4[nH]3)s2)cc1,CN(C)C=O,460.0
CCN(CC)c1ccc(C=C(C#N)c2ccc(C=C(C#N)C(=O)O)s2)cc1,C1CCOC1,505.0
CCN(CC)c1ccc(C=C(C#N)c2ccc(C=C(C#N)C(=O)O)s2)cc1,Cc1ccccc1,516.0
CCN(CC)c1ccc(C=C(C#N)c2nc3ccc(C(=O)O)cc3[nH]2)cc1,CN(C)C=O,421.0
CCN(CC)c1ccc(C=Cc2cc3sc(/C=C4/SC(=S)N(CC(=O)O)C4=O)cc3s2)cc1,C1CCOC1,488.0
CCN(CC)c1ccc(C=Cc2ccc(C=Cc3ccc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)cc3)cc2)cc1,CC#N,424.0
CCN(CC)c1ccc(C=Cc2ccc(C=Cc3ccccc3)cc2)cc1,c1ccccc1,411.0
CCN(CC)c1ccc(C=Cc2ccn3cc(-c4ccc(OC)cc4)nc3c2)cc1,Cc1ccccc1,453.0
CCN(CC)c1ccc(C=Cc2ccn3cc(-c4ccccc4-c4ccc(Cl)cc4)nc3c2)cc1,Cc1ccccc1,410.0
CCN(CC)c1ccc(C=Cc2nc3nc4ccccc4nc3s2)c(OC)c1,CO,485.0
CCN(CC)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2)cc1,CC#N,486.0
CCN(CC)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2OC)cc1,CC#N,496.0
CCN(CC)c1ccc(N=Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1,CC#N,528.0
CCN(CC)c1ccc(N=Nc2ccc3c4c(cccc24)C(=O)N(c2ccc(S(=O)(=O)Nc4nccs4)cc2)C3=O)c(C)c1,CN(C)C=O,552.0
CCN(CC)c1ccc(N=Nc2ccccc2C(=O)O)cc1,CCO,503.0
CCN(CC)c1ccc(N=Nc2ccncc2)cc1,CCO,500.0
CCN(CC)c1ccc(N=Nc2nc3ccc([N+](=O)[O-])cc3s2)c(O)c1,CO,538.0
CCN(CC)c1ccc(N=Nc2nc3ccccc3s2)c(O)c1,CO,528.0
CCN(CC)c1ccc(Nc2cc3oc(-c4ccc(C#N)cc4)nc3c3ccccc23)c(C)c1,C1COCCO1,415.0
CCN(CC)c1ccc(Nc2cc3oc(-c4ccc(C#N)cc4)nc3c3ccccc23)cc1,C1COCCO1,420.0
CCN(CC)c1ccc(Nc2cc3oc(-c4ccc(C#N)cc4)nc3c3ccccc23)cc1,CC(C)=O,420.0
CCN(CC)c1ccc(Nc2cc3oc(-c4ccc(C#N)cc4)nc3c3ccccc23)cc1,ClCCl,420.0
CCN(CC)c1ccc(Nc2cc3oc(-c4ccc(C#N)cc4)nc3c3ccccc23)cc1,c1ccccc1,420.0
CCN(CC)c1ccc(OC)c(C=O)c1,CC#N,412.0
CCN(CC)c1ccc(OC)c(C=O)c1,CC(C)O,418.0
CCN(CC)c1ccc(OC)c(C=O)c1,CCCCCC,400.0
CCN(CC)c1ccc(OC)c(C=O)c1,CCOC(C)=O,406.0
CCN(CC)c1ccc(OC)c(C=O)c1,CO,420.0
CCN(CC)c1ccc(OC)c(C=O)c1,CS(C)=O,424.0
CCN(CC)c1ccc(OC)c(C=O)c1,Cc1ccccc1,411.0
CCN(CC)c1ccc(OC)c(C=O)c1,ClCCl,415.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc(N(CC)CC)cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,C1CCOC1,559.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc(N(CC)CC)cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,CC#N,555.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc(N(CC)CC)cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,CC(C)=O,555.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc(N(CC)CC)cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,Cc1ccccc1,584.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc(N(CC)CC)cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,ClCCl,589.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc(N(CC)CC)cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,Cc1ccccc1,558.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc(N(CC)CC)cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,ClCCl,552.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,C1CCOC1,547.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,CC#N,539.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,CC(C)=O,541.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,Cc1ccccc1,555.0
CCN(CC)c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,ClCCl,559.0
CCN(CC)c1ccc2c(-c3cc(S(=O)(=O)[O-])c(OC)cc3C)cc(/C=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)[o+]c2c1,CCO,706.0
CCN(CC)c1ccc2c(-c3ccc(C(=O)NCCCCCC(=O)O)cc3C(=O)O)c3ccc(N(CC)CCCS(=O)(=O)O)cc3[o+]c2c1,CCO,548.0
CCN(CC)c1ccc2c(-c3ccc(C)cc3)c3ccc(=[NH2+])cc-3[nH]c2c1,O,480.0
CCN(CC)c1ccc2c(-c3ccc(F)c(C)c3)c3ccc(=[NH2+])cc-3[nH]c2c1,O,480.0
CCN(CC)c1ccc2c(-c3ccc(OC)cc3C)cc(/C=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)O)cc4C3(C)CCCC(=O)O)[o+]c2c1,CCO,705.0
CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,CC#N,548.0
CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,CCO,552.0
CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,CN(C)C=O,552.0
CCN(CC)c1ccc2c(-c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,O,562.0
CCN(CC)c1ccc2c(-c3ccc4cc(OC)ccc4c3)c3ccc(=[NH2+])cc-3[nH]c2c1,O,485.0
CCN(CC)c1ccc2c(-c3cccc(OC)c3)c3ccc(=[NH2+])cc-3[nH]c2c1,O,490.0
CCN(CC)c1ccc2c(-c3cccc(S(=O)(=O)[O-])c3)c(C)c(/C=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)[o+]c2c1,CCO,710.0
CCN(CC)c1ccc2c(-c3cccc(S(=O)(=O)[O-])c3)c(C)c(CC/C=C3/N(CCCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)[o+]c2c1,CCO,710.0
CCN(CC)c1ccc2c(-c3ccccc3)c(C)c(/C=C/C=C3/N(CCCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)[o+]c2c1,CCO,707.0
CCN(CC)c1ccc2c(-c3ccccc3)c(C)c(/C=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)[o+]c2c1,CCO,709.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)N(C)CCS(=O)(=O)[O-])c3c([o+]c2c1)/C(=C/C=C/C=C1/N(CCCCCC(=O)O)c2ccc(S(=O)(=O)[O-])cc2C1(C)C)CCC3,CCO,823.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)NCCS(=O)(=O)[O-])c3c([o+]c2c1)/C(=C/C=C1/N(CCCCCC(=O)O)c2ccc(S(=O)(=O)[O-])cc2C1(C)C)CCC3,CCO,726.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/Nc1ccccc1)CCC3,CCO,595.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/Nc1ccccc1)CCC3,ClC(Cl)Cl,608.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/Nc1ccccc1)CCC3,ClCCl,607.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/c1ccc(N(C)C)cc1)CCC3,ClCCl,689.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/c1ccc(N(C)C)s1)CCC3,ClCCl,733.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/c1ccc(O)c(Cl)c1)CCC3,CO,577.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/c1ccc2c(c1)c1ccccc1n2CC)CCC3,ClCCl,646.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3c([o+]c2c1)/C(=C/c1nc(-c2ccccc2)n2ccccc12)CCC3,ClCCl,703.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)O)c3ccc4cc(=O)ccc4c3oc2c1,O,576.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1c(O)cccc1C3,O,575.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1cc(O)ccc1C3,O,545.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(N)cc1CC3,O,574.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(O)cc1C3,CCO,567.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(O)cc1C3,O,567.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(OC)cc1C3,CCO,550.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1cccc(O)c1C3,O,532.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,CC#N,555.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,CCO,539.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,CN(C)C=O,560.0
CCN(CC)c1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[N+](CC)CC)cc-3oc2c1,O,554.0
CCN(CC)c1ccc2c(/C=C/C=C/C=C3\N(CCCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)cc(C(C)(C)C)[o+]c2c1,CCO,734.0
CCN(CC)c1ccc2c(/C=C/C=C3\N(CCCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)cc(C(C)(C)C)[o+]c2c1,CCO,638.0
CCN(CC)c1ccc2c(/C=C/C=C3\N(CCCCCS(=O)(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)cc(C(C)(C)C)[o+]c2c1,CCO,637.0
CCN(CC)c1ccc2c(/C=C3/Sc4ccccc4N3C)cc(N(C)CCCC(=O)O)[o+]c2c1,CCO,478.0
CCN(CC)c1ccc2c(/C=C3\Sc4ccccc4N3C)cc(N(C)CCCN(C)C)[o+]c2c1,CCO,477.0
CCN(CC)c1ccc2c(/C=C3\Sc4ccccc4N3C)cc(N3CCN(CCO)CC3)[o+]c2c1,CCO,481.0
CCN(CC)c1ccc2c(/C=C3\Sc4ccccc4N3C)cc(N3CC[N+](C)(CC[N+](C)(C)C)CC3)[o+]c2c1,CCO,492.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,C1COCCO1,563.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CC#N,602.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CCO,607.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CCOC(C)=O,573.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CN(C)C=O,594.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CO,599.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CS(C)=O,585.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,Cc1ccccc1,561.0
CCN(CC)c1ccc2c(C#N)c(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,ClCCl,611.0
CCN(CC)c1ccc2c(C#N)c(C=C(C#N)c3nc4ccccc4s3)c(=O)oc2c1,Cc1ccccc1,611.0
CCN(CC)c1ccc2c(C#N)c3c(oc2c1)c(C#N)c(=N)n1c2ccccc2nc31,ClC(Cl)Cl,640.0
CCN(CC)c1ccc2c(C(C)(C)C)cc(/C=C/C=C3/N(CCCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)[o+]c2c1,CCO,691.0
CCN(CC)c1ccc2c(C(C)(C)C)cc(/C=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)[o+]c2c1,CCO,692.0
CCN(CC)c1ccc2c(C(F)(F)C(F)(F)F)cc(=O)oc2c1,ClCCl,409.0
CCN(CC)c1ccc2c(C(F)(F)F)cc(=O)oc2c1,C1CCCCC1,376.0
CCN(CC)c1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC#N,396.0
CCN(CC)c1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCO,400.0
CCN(CC)c1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCOC(C)=O,392.0
CCN(CC)c1ccc2c(C(F)(F)F)cc(=O)oc2c1,ClCCl,401.0
CCN(CC)c1ccc2c(C(F)(F)F)cc(=O)oc2c1,OCC(O)CO,413.0
CCN(CC)c1ccc2c(C)c(-c3ccc(N4C(=O)C=CC4=O)cc3)c(=O)oc2c1,CO,384.0
CCN(CC)c1ccc2c(C)c(C#CC=C(C#N)C(=O)O)c(=O)oc2c1,ClCCl,440.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,C1CCCCC1,350.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,CC#N,367.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,CCCCCCCCO,373.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,CCCCCCO,373.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,CCCCO,374.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,CCCO,376.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,CCOC(C)=O,361.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,ClCCl,372.0
CCN(CC)c1ccc2c(C)cc(=O)oc2c1,OCC(O)CO,384.0
CCN(CC)c1ccc2c(O)c(C(=O)C=CC=C3N(C)c4ccccc4C3(C)C)c(=O)oc2c1,CC#N,566.0
CCN(CC)c1ccc2c(O)c(C(=O)C=Cc3ccc4c(c3)c3ccccc3n4CC)c(=O)oc2c1,ClCCl,545.0
CCN(CC)c1ccc2c(O)c(N=Nc3ccc(C(=O)O)cc3)c(=O)oc2c1,CO,480.0
CCN(CC)c1ccc2c(O)c(N=Nc3ccc(OC)cc3)c(=O)oc2c1,CO,480.0
CCN(CC)c1ccc2c(c1)C(C)(C)C(=O)C=C2,O,429.0
CCN(CC)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2,CO,608.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,Brc1ccccc1,416.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,C1CCOC1,407.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,C1COCCO1,401.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CC#N,406.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CC(C)=O,405.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CC(C)O,416.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CC(C)OC(C)C,397.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCC(C)(C)O,412.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCCCCC,393.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCCCCCCCO,420.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCCCO,420.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCCCOCCCC,400.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCN(CC)CC,396.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCO,418.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CCOC(C)=O,403.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CN(C)C=O,413.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CO,417.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,CS(C)=O,418.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,Cc1ccccc1,404.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,ClC(Cl)(Cl)Cl,403.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,ClC(Cl)Cl,414.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,ClCCl,412.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(-c3oc4ccccc4c(=O)c3OC)ccc1-2,O,410.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,C1CCOC1,393.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,C1COCCO1,390.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,CC#N,394.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,CCO,395.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,CN(C)C=O,399.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,CO,396.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,Cc1ccccc1,395.0
CCN(CC)c1ccc2c(c1)C(C)(C)c1cc(C=O)ccc1-2,ClCCl,399.0
CCN(CC)c1ccc2c(c1)Cc1c-2[o+]c2c(c1-c1ccccc1OC)Cc1cc(N(CC)CC)ccc1-2,CCO,630.0
CCN(CC)c1ccc2c(c1)Cc1c-2[o+]c2c3c4c(cc2c1-c1ccccc1C(=O)[O-])CCCN4CCC3,O,604.0
CCN(CC)c1ccc2c(c1)O/C(=C/C=C1/C(=O)N(CCCCCC(=O)O)C(=O)N(CCCS(=O)(=O)O)C1=O)C=C2C(C)(C)C,CCO,610.0
CCN(CC)c1ccc2c(c1)O/C(=C/C=C1/C(=O)N(CCCCCC(=O)O)C(=O)N(CCCS(=O)(=O)[O-])C1=O)C=C2c1cc(S(=O)(=O)O)c(OC)cc1C,CCO,626.0
CCN(CC)c1ccc2c(c1)O/C(=C/C=C1/C(=O)N(CCCCCC(=O)O)C(=O)N(CCCS(=O)(=O)[O-])C1=O)C=C2c1cc(S(=O)(=O)[O-])c(OC)cc1C,CCO,626.0
CCN(CC)c1ccc2c(c1)O/C(=C/C=C1C=CC(=[N+](CC)CC)C=C1)C=C2c1ccccc1C(=O)O,O,676.0
CCN(CC)c1ccc2c(c1)O/C(=C/CC1C(=O)N(CCCCCC(=O)O)C(=O)N(CCCS(=O)(=O)[O-])C1=O)C(C)=C2c1cccc(C(=O)O)c1,CCO,624.0
CCN(CC)c1ccc2c(c1)O/C(=C\C=C\C=c1/cc3c(oc1=O)=CC(=[N+](CC)CC)C=C3)C=C2c1ccccc1C(=O)O,CO,652.0
CCN(CC)c1ccc2c(c1)O/C(=C\C=c1/cc3c(oc1=O)=CC(=[N+](CC)CC)C=C3)C=C2c1ccccc1C(=O)O,CO,630.0
CCN(CC)c1ccc2c(c1)OC(=O)[C@@H](C(=O)O)C2,CC#N,445.0
CCN(CC)c1ccc2c(c1)OC(C(C)(C)C)=C/C2=C\C=C1\C(=O)N(CCCCCC(=O)O)C(=O)N(CCCS(=O)(=O)O)C1=O,CCO,558.0
CCN(CC)c1ccc2c(c1)OC(C(C)(C)C)=C/C2=C\C=C1\C(=O)N(CCCCCC(=O)O)C(=O)N(CCCS(=O)(=O)[O-])C1=O,CCO,558.0
CCN(CC)c1ccc2c(c1)OC1=C(/C=C/C3=[N+](C)c4ccc5ccccc5c4C3(C)C)CCCC1=C2c1ccccc1C(=O)O,CC#N,726.0
CCN(CC)c1ccc2c(c1)OC1=C(/C=C/C3=[N+](C)c4ccc5ccccc5c4C3(C)C)CCCC1=C2c1ccccc1C(=O)O,CCO,720.0
CCN(CC)c1ccc2c(c1)OC1=C(/C=C/C3=[N+](C)c4ccc5ccccc5c4C3(C)C)CCCC1=C2c1ccccc1C(=O)O,CO,720.0
CCN(CC)c1ccc2c(c1)OC1=C(/C=C/C3=[N+](C)c4ccc5ccccc5c4C3(C)C)CCCC1=C2c1ccccc1C(=O)O,ClC(Cl)Cl,736.0
CCN(CC)c1ccc2c(c1)OC1=C(/C=C/C3=[N+](CC)c4ccccc4C3(C)C)CCCC1=C2/C=C1/N(CC)c2ccccc2C1(C)C,ClCCl,720.0
CCN(CC)c1ccc2c(c1)OC1=C(/C=C/C3=[N+](CC)c4ccccc4C3(C)C)CCCC1=C2c1ccccc1C(=O)O,O,710.0
CCN(CC)c1ccc2c(c1)OC1=NC(c3ccc(C(=O)O)cc3)n3c(nc4ccccc43)C1=C2,CS(C)=O,451.0
CCN(CC)c1ccc2c(c1)OC1=NC(c3ccc(O)c(C(=O)O)c3)n3c(nc4ccccc43)C1=C2,CS(C)=O,448.0
CCN(CC)c1ccc2c(c1)OC1=[N+](c3ccc(I)cc3)[B-](F)(F)n3c(nc4ccccc43)C1=C2,ClCCl,496.0
CCN(CC)c1ccc2c(c1)Oc1c3c4c(cc1=C2c1ccccc1C(=O)[O-])CCC[N+]=4CCC3,O,566.0
CCN(CC)c1ccc2c(c1)Oc1cc3c(cc1=C2c1ccccc1C(=O)[O-])Sc1ccccc1[N+]=3CC,CCO,606.0
CCN(CC)c1ccc2c(c1)P(C)(=O)C1=CC(=[N+](CC)CC)C=CC1=C2c1c(C)cc(C)cc1C,O,696.0
CCN(CC)c1ccc2c(c1)P(C)(=O)C1=CC(=[N+](CC)CC)C=CC1=C2c1ccccc1C,O,694.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3c(C)c4oc(=O)c5c(=O)oc6cc(N(CC)CC)ccc6c5c4cc3c12,CS(C)=O,463.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3c(C)c4oc(=O)c5c(=O)oc6cc(N(CC)CC)ccc6c5c4cc3c12,ClCCl,458.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3c(OC)cccc3c12,CS(C)=O,462.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3c(OC)cccc3c12,ClCCl,458.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3cc(C#Cc4ccc(C#N)cc4)ccc3c12,CS(C)=O,481.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3cc(C#Cc4ccc(C#N)cc4)ccc3c12,ClCCl,476.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3cc(C#Cc4ccc(N(C)C)cc4)ccc3c12,CS(C)=O,468.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3cc(C#Cc4ccc(N(C)C)cc4)ccc3c12,ClCCl,459.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3cc([N+](=O)[O-])ccc3c12,CS(C)=O,498.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(=O)oc3cc([N+](=O)[O-])ccc3c12,ClCCl,494.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(C)nc3c(c(-c4ccccc4)nn3-c3ccccc3)c12,ClCCl,410.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(C)nc3c(c(-c4ccccc4)nn3C)c12,ClCCl,408.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(C)nc3c(c(C)nn3-c3ccccc3)c12,ClCCl,403.0
CCN(CC)c1ccc2c(c1)oc(=O)c1c(C)nc3c(cnn3-c3ccccc3)c12,ClCCl,403.0
CCN(CC)c1ccc2c(c1)oc(=O)c1cc3c(-c4ccccc4)nn(-c4ccccc4)c3nc12,ClCCl,359.0
CCN(CC)c1ccc2c(c1)oc(=O)c1cc3ccc(=[N+](CC)CC)cc-3oc12,O,580.0
CCN(CC)c1ccc2c(c1)oc(=O)c1cnc3c(cnn3-c3ccccc3)c12,ClCCl,405.0
CCN(CC)c1ccc2c(ccc3c(-c4ccc(N)c(N)c4)c4ccc5cc(N(CC)CC)ccc5c4[o+]c32)c1,O,666.0
CCN(CC)c1ccc2c(ccc3c(-c4ccc5nn[nH]c5c4)c4ccc5cc(N(CC)CC)ccc5c4[o+]c32)c1,O,683.0
CCN(CC)c1ccc2c3c(c(=O)oc2c1)C(C=Cc1ccc2c(c1)c1ccccc1n2CC)=[O+][B-](F)(F)O3,CO,545.0
CCN(CC)c1ccc2cc(-c3cc(-c4ccccc4C(=O)O)c4ccc(=[N+](CC)CC)cc-4o3)c(=O)oc2c1,ClCCl,662.0
CCN(CC)c1ccc2cc(-c3cc(-c4ccccc4C(=O)O)c4ccc(N(CC)CC)cc4[o+]3)c(=O)oc2c1,ClCCl,662.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,C1CCOC1,512.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,CC#N,514.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,CC(C)=O,514.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,CCOC(C)=O,509.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,CN(C)C=O,521.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,CO,514.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,CS(C)=O,527.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,Cc1ccccc1,509.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,ClC(Cl)Cl,517.0
CCN(CC)c1ccc2cc(-c3cc(SC)c(C#N)c(=O)o3)c(=O)oc2c1,ClCCl,520.0
CCN(CC)c1ccc2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6cc7ccc(N(CC)CC)cc7oc6=O)cc5)c5ccccc45)cc3)c(=O)oc2c1,ClC(Cl)Cl,412.0
CCN(CC)c1ccc2cc(-c3ccc(-c4ccc(-c5cc6ccc(N(CC)CC)cc6oc5=O)cc4)cc3)c(=O)oc2c1,ClCCl,417.0
CCN(CC)c1ccc2cc(-c3ccc(-c4ccc(-c5cc6ccccc6oc5=O)cc4)cc3)c(=O)oc2c1,ClCCl,409.0
CCN(CC)c1ccc2cc(-c3ccc(-c4ccc5ccc6c(-c7ccc(-c8cc9ccc(N(CC)CC)cc9oc8=O)cc7)ccc7ccc4c5c76)cc3)c(=O)oc2c1,ClC(Cl)Cl,412.0
CCN(CC)c1ccc2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c(=O)oc2c1,CN(C)C=O,496.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CC(C)=O,366.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCCCCC,362.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCCCO,365.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCCO,365.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCO,366.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCOC(C)=O,365.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CN(C)C=O,370.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CO,364.0
CCN(CC)c1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,ClC(Cl)Cl,368.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CC(C)=O,375.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CCCCCC,373.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CCCCO,378.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CCCO,378.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CCO,376.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CCOC(C)=O,374.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CN(C)C=O,379.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CO,376.0
CCN(CC)c1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,ClC(Cl)Cl,383.0
CCN(CC)c1ccc2cc(-c3ccc4ccc(N(CC)CC)cc4[o+]3)c(=O)oc2c1,ClCCl,670.0
CCN(CC)c1ccc2cc(-c3cn4cc(C)ccc4n3)c(=O)oc2c1,ClC(Cl)Cl,424.0
CCN(CC)c1ccc2cc(-c3cn4cc(OC)ccc4n3)c(=O)oc2c1,ClC(Cl)Cl,434.0
CCN(CC)c1ccc2cc(-c3cn4cc5ccccc5cc4n3)c(=O)oc2c1,ClC(Cl)Cl,434.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,C1CCOC1,408.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,CC#N,421.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,CCO,424.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,CCOC(C)=O,407.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,CN(C)C=O,425.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,CO,423.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,CS(C)=O,428.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,Cc1ccccc1,407.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,ClC(Cl)Cl,425.0
CCN(CC)c1ccc2cc(-c3cn4ccccc4n3)c(=O)oc2c1,ClCCl,429.0
CCN(CC)c1ccc2cc(-c3csc(N)c3C#N)c(=O)oc2c1,C1CCOC1,403.0
CCN(CC)c1ccc2cc(-c3csc(N)c3C#N)c(=O)oc2c1,CO,406.0
CCN(CC)c1ccc2cc(-c3csc(N)c3C#N)c(=O)oc2c1,CS(C)=O,406.0
CCN(CC)c1ccc2cc(-c3csc(N)c3C#N)c(=O)oc2c1,Cc1ccccc1,403.0
CCN(CC)c1ccc2cc(-c3csc(N)c3C#N)c(=O)oc2c1,ClCCl,407.0
CCN(CC)c1ccc2cc(-c3nc4c5cccc6ccc7cccc(c7c65)c4n3-c3ccc(C(C)(C)C)cc3)c(=O)oc2c1,ClCCl,410.0
CCN(CC)c1ccc2cc(-c3nc4c5ccccc5c5ccccc5c4n3-c3ccc(C(C)(C)C)cc3)c(=O)oc2c1,ClCCl,410.0
CCN(CC)c1ccc2cc(-c3nc4cc(C(=O)Nc5ccc(C)cc5[N+](=O)[O-])ccc4o3)c(=O)oc2c1,ClCCl,445.0
CCN(CC)c1ccc2cc(-c3nc4cc(C(=O)Nc5cccc(C)c5)ccc4o3)c(=O)oc2c1,ClCCl,440.0
CCN(CC)c1ccc2cc(-c3nc4cc(C(=O)Nc5cccc(OC)c5)ccc4o3)c(=O)oc2c1,ClCCl,437.0
CCN(CC)c1ccc2cc(-c3nc4cc(C(=O)Nc5ccccc5)ccc4o3)c(=O)oc2c1,ClCCl,442.0
CCN(CC)c1ccc2cc(-c3nc4ccccc4n3-c3ccccc3)c(=O)oc2c1,ClCCl,410.0
CCN(CC)c1ccc2cc(-c3nc4ccccc4n3C)c(=O)oc2c1,CC#N,404.5
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,Brc1ccccc1,443.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,C1CCOC1,433.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,C1COCCO1,430.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CC#N,433.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CC(C)=O,432.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CC(C)O,443.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CC(C)OC(C)C,425.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCC(C)(C)O,439.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCCCCC,404.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCCCCCCCO,446.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCCCO,446.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCCCOCCCC,428.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCN(CC)CC,427.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCO,445.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CCOC(C)=O,429.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CN(C)C=O,440.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CO,445.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,CS(C)=O,445.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,Cc1ccccc1,435.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,ClC(Cl)(Cl)Cl,436.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,ClC(Cl)Cl,443.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,ClCCl,440.0
CCN(CC)c1ccc2cc(-c3oc4ccccc4c(=O)c3OC)oc2c1,O,447.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(=O)oc2c1,CC(C)=O,504.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(=O)oc2c1,CCOC(C)=O,504.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(=O)oc2c1,CN(C)C=O,532.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(=O)oc2c1,CS(C)=O,542.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(=O)oc2c1,Cc1ccccc1,508.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(=O)oc2c1,ClCCl,526.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc4c(c3)c3ccccc3n4CC)c(=O)oc2c1,CC(C)=O,518.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc4c(c3)c3ccccc3n4CC)c(=O)oc2c1,CCOC(C)=O,508.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc4c(c3)c3ccccc3n4CC)c(=O)oc2c1,CN(C)C=O,532.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc4c(c3)c3ccccc3n4CC)c(=O)oc2c1,CS(C)=O,538.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc4c(c3)c3ccccc3n4CC)c(=O)oc2c1,Cc1ccccc1,508.0
CCN(CC)c1ccc2cc(/C(Cl)=C/C=C/C(=C(C#N)C#N)c3ccc4c(c3)c3ccccc3n4CC)c(=O)oc2c1,ClCCl,526.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,C1COCCO1,497.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CC#N,510.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CCO,516.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CCOC(C)=O,506.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CN(C)C=O,529.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CO,509.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,CS(C)=O,519.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,Cc1ccccc1,500.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4o3)c(=O)oc2c1,ClCCl,511.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,C1COCCO1,498.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,CC#N,506.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,CCO,511.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,CCOC(C)=O,504.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,CN(C)C=O,528.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,CO,512.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,CS(C)=O,525.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,Cc1ccccc1,501.0
CCN(CC)c1ccc2cc(/C=C(\C#N)c3nc4ccccc4s3)c(=O)oc2c1,ClCCl,509.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,C1CCOC1,518.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,C1COCCO1,514.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CC#N,521.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CC(C)=O,519.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CCOC(C)=O,514.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CN(C)C=O,527.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CS(C)=O,540.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,Cc1ccccc1,518.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,ClC(Cl)Cl,520.0
CCN(CC)c1ccc2cc(/C=C/C(=O)/C=C(O)/C=C/c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,ClCCl,523.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,C1CCOC1,481.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,C1COCCO1,475.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CC#N,488.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CC(C)=O,487.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CCO,489.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CCOC(C)=O,478.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CN(C)C=O,495.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CS(C)=O,500.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,Cc1ccccc1,477.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,ClC(Cl)Cl,488.0
CCN(CC)c1ccc2cc(/C=C/C(=O)c3cc4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,ClCCl,490.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,CC#N,456.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,CC(C)=O,456.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,CCOC(C)=O,447.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,CO,458.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,CS(C)=O,470.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,Cc1ccccc1,447.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,ClC(Cl)Cl,455.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C/C(C)=O)c(=O)oc2c1,ClCCl,456.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,C1COCCO1,513.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,CC#N,532.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,CC(C)=O,526.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,CCOC(C)=O,516.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,CN(C)C=O,546.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,CS(C)=O,556.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,Cc1ccccc1,511.0
CCN(CC)c1ccc2cc(/C=C/C(O)=C3\CC/C(=C\c4cc5ccc(N(CC)CC)cc5oc4=O)C3=O)c(=O)oc2c1,ClC(Cl)Cl,525.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,C1COCCO1,629.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,CC#N,655.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,CC(C)=O,653.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,CCOC(C)=O,636.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,CN(C)C=O,673.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,CS(C)=O,690.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,Cc1ccccc1,629.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,ClC(Cl)Cl,644.0
CCN(CC)c1ccc2cc(/C=C/C3=C4CC/C(=C\c5cc6ccc(N(CC)CC)cc6oc5=O)C4=[O+][B-](F)(F)O3)c(=O)oc2c1,ClCCl,653.0
CCN(CC)c1ccc2cc(/C=C/c3cc[n+](C(C)CCCCC(=O)O)cc3S(=O)(=O)[O-])c(=O)oc2c1,CCO,522.0
CCN(CC)c1ccc2cc(/C=C/c3cc[n+](CCCCCC(=O)O)cc3)c(=O)oc2c1,CCO,497.0
CCN(CC)c1ccc2cc(/C=C/c3ccc(N(c4ccc(/C=C(/C#N)C(=O)O)cc4)c4ccc(/C=C/c5cc6ccc(N(CC)CC)cc6oc5=O)cc4)cc3)c(=O)oc2c1,ClCCl,454.0
CCN(CC)c1ccc2cc(/C=C/c3ccc(N(c4ccc(/C=C/c5cc6ccc(N(CC)CC)cc6oc5=O)cc4)c4ccc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)cc4)cc3)c(=O)oc2c1,ClCCl,465.0
CCN(CC)c1ccc2cc(/C=C/c3ccc(S(=O)(=O)[O-])c[n+]3CCCCCC(=O)O)c(=O)oc2c1,CCO,504.0
CCN(CC)c1ccc2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])c(=O)oc2c1,C1CCOC1,513.0
CCN(CC)c1ccc2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])c(=O)oc2c1,CC#N,486.0
CCN(CC)c1ccc2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])c(=O)oc2c1,CC(C)=O,530.0
CCN(CC)c1ccc2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])c(=O)oc2c1,CS(C)=O,494.0
CCN(CC)c1ccc2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])c(=O)oc2c1,Cc1ccccc1,487.0
CCN(CC)c1ccc2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])c(=O)oc2c1,O,481.0
CCN(CC)c1ccc2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])c(=O)oc2c1,OCC(O)CO,496.0
CCN(CC)c1ccc2cc(/C=C/c3ccccc3)c(=O)oc2c1,CC#N,421.0
CCN(CC)c1ccc2cc(/C=C3\CCCc4c3[o+]c3cc(N(CC)CC)ccc3c4-c3ccccc3C(=O)O)c(=O)oc2c1,ClCCl,678.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)C(C)C)oc2c1,CCO,422.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)C(C)C)oc2c1,ClCCl,428.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)c3ccc(C)cc3)oc2c1,CCO,430.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)c3ccc(C)cc3)oc2c1,ClCCl,436.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)c3ccc(F)cc3)oc2c1,CCO,442.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)c3ccc(F)cc3)oc2c1,ClCCl,444.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)c3ccco3)oc2c1,CCO,424.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(=O)c3ccco3)oc2c1,ClCCl,430.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(C)=O)oc2c1,CCO,422.0
CCN(CC)c1ccc2cc(C#N)/c(=N\C(C)=O)oc2c1,ClCCl,430.0
CCN(CC)c1ccc2cc(C#N)c(=N)oc2c1,ClCCl,428.0
CCN(CC)c1ccc2cc(C#N)c(=O)oc2c1,ClCCl,428.0
CCN(CC)c1ccc2cc(C(=O)NN)c(=O)oc2c1,CO,420.0
CCN(CC)c1ccc2cc(C(=O)O)c(=O)oc2c1,O,409.0
CCN(CC)c1ccc2cc(C=C(C#N)c3nc4ccccc4o3)c(=O)oc2c1,Cc1ccccc1,529.0
CCN(CC)c1ccc2cc(C=C(C#N)c3nc4ccccc4s3)c(=O)oc2c1,Cc1ccccc1,528.0
CCN(CC)c1ccc2cc(C=CC(=O)c3c(O)c4ccc(N(CC)CC)cc4oc3=O)c(=O)oc2c1,CC#N,511.0
CCN(CC)c1ccc2cc(C=CC(=O)c3c(O)c4ccccc4n(C)c3=O)c(=O)oc2c1,CO,511.0
CCN(CC)c1ccc2cc(C=CC(=O)c3c(O)c4ccccc4oc3=O)c(=O)oc2c1,ClCCl,503.0
CCN(CC)c1ccc2cc(C=CC3=[O+][B-](F)(F)Oc4c3c(=O)n(C)c3ccccc43)c(=O)oc2c1,CO,612.0
CCN(CC)c1ccc2cc(C=CC3=[O+][B-](F)(F)Oc4c3c(=O)oc3ccccc43)c(=O)oc2c1,CO,623.0
CCN(CC)c1ccc2cc3c([o+]c2c1)/C(=C/Nc1ccccc1)CCC3,CCO,605.0
CCN(CC)c1ccc2cc3c([o+]c2c1)/C(=C/Nc1ccccc1)CCC3,ClC(Cl)Cl,616.0
CCN(CC)c1ccc2cc3c([o+]c2c1)/C(=C/Nc1ccccc1)CCC3,ClCCl,615.0
CCN(CC)c1ccc2cc3c(cc2c1)C1(c2ccccc2Oc2ccccc21)c1cc2cc(N(CC)CC)ccc2cc1C3=O,CC#N,452.0
CCN(CC)c1ccc2cc3c(nc(=Nc4ccc(Br)cc4)n4c5ccccc5nc34)oc2c1,ClC(Cl)Cl,529.0
CCN(CC)c1ccc2cc3c(oc2c1)c(C#N)c(=NC1=CC(=S(=O)=O)C(C(=O)O)C=C1)n1c2ccccc2nc31,CC#N,570.0
CCN(CC)c1ccc2cc3cc(-c4ccc(C#N)cc4)n(CCCC(=O)OCc4ccccc4)c(=O)n3c2c1,CCO,409.0
CCN(CC)c1ccc2cc3cc(-c4ccc(S(C)(=O)=O)cc4)n(CCCC(=O)OCc4ccccc4)c(=O)n3c2c1,CCO,401.0
CCN(CC)c1ccc2cc3ccc(=[N+](CC)CC)cc-3oc2c1,CC#N,525.0
CCN(CC)c1ccc2cc3ccc(=[N+](CC)CC)cc-3oc2c1,CCO,526.0
CCN(CC)c1ccc2cc3ccc(=[N+](CC)CC)cc-3oc2c1,CN(C)C=O,535.0
CCN(CC)c1ccc2cc3ccc(=[N+](CC)CC)cc-3oc2c1,O,550.0
CCN(CC)c1ccc2ccc(=O)oc2c1,CCCCCC,353.0
CCN(CC)c1ccc2ccc(=O)oc2c1,CCCCCCC,352.0
CCN(CC)c1ccc2ccc(=O)oc2c1,CCCO,379.0
CCN(CC)c1ccc2ccc(=O)oc2c1,CCOCC,359.0
CCN(CC)c1ccc2ccc(=O)oc2c1,CN(C)C=O,379.0
CCN(CC)c1ccc2ccc(=O)oc2c1,Cc1ccccc1,369.0
CCN(CC)c1ccc2ccc(=O)oc2c1,ClC(Cl)(Cl)Cl,360.0
CCN(CC)c1ccc2ccc(=O)oc2c1,ClC(Cl)Cl,375.0
CCN(CC)c1ccc2ccc(=O)oc2c1,ClCCl,376.0
CCN(CC)c1ccc2ccc(=O)oc2c1,c1ccccc1,355.0
CCN(CC)c1ccc2n1[B-](F)(F)[N+]1=CC(/C=C/C(=O)OC(C)(C)C)=CC1=C2c1c(C)cc(C)cc1C,ClCCl,478.0
CCN(CC)c1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccc(C)cc1,ClCCl,473.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,C1COCCO1,519.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,CC#N,535.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,CC(C)=O,533.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,CCCCCC,508.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,CCO,549.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,CCOC(C)=O,524.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,CO,553.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,CS(C)=O,552.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,Cc1ccccc1,524.0
CCN(CC)c1ccc2nc3c4ccccc4c(=O)cc-3oc2c1,ClCCl,539.0
CCN(CC)c1ccc2nc3c4ccccc4c(=[NH2+])cc-3oc2c1,O,635.0
CCN(CC)c1cccc(C=O)c1,CC#N,380.0
CCN(CC)c1cccc(C=O)c1,CC(C)O,382.0
CCN(CC)c1cccc(C=O)c1,CCCCCC,367.0
CCN(CC)c1cccc(C=O)c1,CCOC(C)=O,376.0
CCN(CC)c1cccc(C=O)c1,CO,382.0
CCN(CC)c1cccc(C=O)c1,CS(C)=O,384.0
CCN(CC)c1cccc(C=O)c1,Cc1ccccc1,380.0
CCN(CC)c1cccc(C=O)c1,ClCCl,382.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CC(C)=O,390.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCCCCC,388.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCCCCCCCO,393.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCCCO,392.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCCO,391.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCO,392.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCOC(C)=O,389.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CN(C)C=O,394.0
CCN(CC)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CO,391.0
CCN(CC)c1nc(-c2ccc(C)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,C1CCOC1,482.0
CCN(CC)c1nc(-c2ccc(C)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,CC#N,487.0
CCN(CC)c1nc(-c2ccc(C)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,CCCCCC,452.0
CCN(CC)c1nc(-c2ccc(C)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,CS(C)=O,504.0
CCN(CC)c1nc(-c2ccc(C)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,Cc1ccccc1,477.0
CCN(CC)c1nc(-c2ccc(C)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,ClCCl,494.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,C1CCOC1,461.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,CC#N,469.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,CCCCCC,431.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,CS(C)=O,483.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,Cc1ccccc1,459.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,ClCCl,477.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])s2)s1,C1CCOC1,479.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])s2)s1,CC#N,487.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])s2)s1,CCCCCC,446.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])s2)s1,CS(C)=O,503.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])s2)s1,Cc1ccccc1,474.0
CCN(CC)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])s2)s1,ClCCl,492.0
CCN(CCC(=O)O)c1ccc(/C=C/C2=[N+](C)C3=C(C4C=CC=CC4C=C3)C2(C)C)cc1,CCO,577.0
CCN(CCC(=O)O)c1ccc(/C=C/C2=[N+](C)c3ccccc3C2(C)C)cc1,CCO,561.0
CCN(CCCCCC(=O)O)c1ccc2cc(-c3cc[n+](CCCS(=O)(=O)[O-])cc3)c(=O)oc2c1,CCO,488.0
CCN(CCCCCC(=O)O)c1ccc2cc(/C=C/c3cc[n+](CCCS(=O)(=O)[O-])cc3S(=O)(=O)[O-])c(=O)oc2c1,CCO,526.0
CCN(CCCCCC(=O)O)c1ccc2cc(C(=O)NCCS(=O)(=O)[O-])c(=O)oc2c1,CCO,418.0
CCN(CCCN(C)C)c1ccc2c(-c3cc(C)c(OC)c(C)c3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3cc(C)cc(C)c3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(C(C)(C)C)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(F)c(C)c3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(F)c(Cl)c3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(F)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(OC)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(Oc4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc(SC)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc4c(c3)OCO4)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc4cc(OC)ccc4c3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCN(C)C)c1ccc2c(-c3ccc4ccccc4c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCN(CCCN(C)C)c1ccc2c(-c3cccc(F)c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCN(CCCN(C)C)c1ccc2c(-c3cccc(OC)c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CCN(CCCN(C)C)c1ccc2c(-c3ccccc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCN(CCCS(=O)(=O)O)c1ccc2c(-c3ccc(C(=O)NCCCCCC(=O)O)cc3C(=O)O)c3ccc(N(CC)CCCS(=O)(=O)O)cc3[o+]c2c1,CCO,556.0
CCN(CCCS(=O)(=O)O)c1ccc2c(-c3ccccc3C(=O)N(C)CCCC(=O)O)c3c([o+]c2c1)=CC1C(C=3)C(C)=CC(C)(C)N1CCCS(=O)(=O)O,CCO,584.0
CCN(CCCS(=O)(=O)O)c1ccc2c(/C=C/C=C3\N(CCCCCS(=O)(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)cc(C(C)(C)C)[o+]c2c1,CCO,636.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(-c3ccc(C(=O)NCCCCCC(=O)O)cc3C(=O)O)c3ccc(N(CC)CCCS(=O)(=O)O)cc3[o+]c2c1,CCO,556.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(-c3ccc(C(=O)NCCCCCC(=O)O)cc3C(=O)O)c3ccc(N(CC)CCCS(=O)(=O)[O-])cc3[o+]c2c1,CCO,556.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(-c3ccccc3C(=O)N(C)CCCC(=O)O)c3c([o+]c2c1)=CC1C(C=3)C(C)=CC(C)(C)N1CCCS(=O)(=O)[O-],CCO,584.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(/C=C/C=C/C=C3\N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)cc(C(C)(C)C)[o+]c2c1,CCO,735.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(/C=C/C=C3\N(CCCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)cc(C(C)(C)C)[o+]c2c1,CCO,638.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(/C=C/C=C3\N(CCCCCS(=O)(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)cc(C(C)(C)C)[o+]c2c1,CCO,636.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(C(C)(C)C)cc(/C=C/C=C/C=C3/N(CCCS(=O)(=O)[O-])c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)[o+]c2c1,CCO,785.0
CCN(CCCS(=O)(=O)[O-])c1ccc2c(C(C)(C)C)cc(/C=C/C=C3/N(CCC[SH](=O)([O-])O)c4ccc(S(=O)(=O)[O-])cc4C3(C)CCCC(=O)O)[o+]c2c1,CCO,692.0
CCN(CCCS(=O)(=O)[O-])c1ccc2nc3cc/c(=[N+](/C)CCC(=O)O)cc-3oc2c1,CCO,635.0
CCN(CCO)c1c(F)cc2c(c1F)OC1=C(/C=C/C3=[N+](C)c4ccccc4C3(C)C)CCCC1=C2,CCO,619.0
CCN(CCO)c1c(F)cc2c(c1F)OC1=C(/C=C/C3=[N+](C)c4ccccc4C3(C)C)CCCC1=C2,ClC(Cl)Cl,606.0
CCN(CCO)c1ccc(C(C#N)=C(C#N)C#N)cc1,C1CCCCC1,601.0
CCN(N)CCN(CCN(N)CC)c1ccc([N+](=O)[O-])c2nonc12,CC(C)=O,345.0
CCN1/C(=C/C2=C([O-])/C(=C/C3=[N+](CC)c4ccc(C(=O)O)cc4C3(C)C)C2=O)C(C)(C)c2ccccc21,CCO,636.0
CCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CC)c4ccc(C(=O)O)cc4C3(C)C)C2=O)C(C)(C)c2cc(C(=O)O)ccc21,CS(C)=O,664.0
CCN1/C(=C/C2=C([O-])/C(=C\C3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2ccccc21,CS(C)=O,652.0
CCN1/C(=C/C2=C3CCCC(/C=C/C4=[N+](CC)c5ccc6ccccc6c5C4(C)C)=C3Oc3c2cc2c4c3CCCN4CCC2)C(C)(C)c2ccccc21,ClCCl,724.0
CCN1/C(=C/C2=C3CCCC(/C=C/C4=[N+](CC)c5ccccc5C4(C)C)=C3Oc3cc(O)ccc32)C(C)(C)c2ccccc21,ClCCl,714.0
CCN1/C(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CS(C)=O,552.0
CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc(C(=O)O)cc3C2(C)C)C(C)(C)c2cc(C(=O)O)ccc21,CCO,571.0
CCN1/C(=C/C=C/C=C/C2=[N+](CC)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2cc(C(=O)O)ccc21,CCO,651.0
CCN1/C(=C/C=C2\CCCc3c2[o+]c2cc4c(cc2c3-c2ccccc2C(=O)N(C)CCCC(=O)O)C(CS(=O)(=O)[O-])=CC(C)(C)N4CC)C(C)(C)c2c1ccc1c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])cc21,CCO,765.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,C1CCCCC1,682.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,C1CCOC1,681.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,C1COCCO1,680.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,CC#N,674.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,CN(C)C=O,682.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,CO,671.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,CS(C)=O,685.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,Cc1ccccc1,686.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4c(ccc5ccc(C)nc45)C3(C)C)C2=O)C(C)(C)c2ccc3ccc(C)nc3c21,ClC(Cl)Cl,678.0
CCN1/C(=C\C2=C([O-])/C(=C/C3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,634.0
CCN1/C(=C\C=C2/SC(=S)N(CC(=O)O)C2=O)C(C)(C)c2ccccc21,CCO,490.0
CCN1/C(=C\C=C2/SC(=S)N(CC(=O)O)C2=O)Sc2ccccc21,CCO,520.0
CCN1/C(=C\C=C\C2=[N+](CC)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CO,544.0
CCN1/C(=C\C=C\C=C\C2=[N+](CC)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CO,638.0
CCN1/C(=C\C=C\C=C\C=C\C2=[N+](CC)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CCO,743.0
CCN1/C(=C\C=C\C=C\C=C\c2oc3ccccc3[n+]2CC)Oc2ccccc21,CCO,687.0
CCN1/C(=C\C=C\C=C\c2oc3ccccc3[n+]2CC)Oc2ccccc21,CCO,582.0
CCN1/C(=C\C=C\C=C\c2sc3ccccc3[n+]2CC)Sc2ccccc21,CCO,656.0
CCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,C1CCCCC1,359.0
CCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,Cc1ccccc1,362.0
CCN1/C(=C\c2c(-c3ccc(N(C)C)cc3)c(=O)c2=O)C=Cc2ccccc21,ClCCl,509.0
CCN1C(=C/C(C)=c2\s/c(=C3\SC(=S)N(CC(=O)O)C3=O)n(CC(=O)O)c2=O)Sc2ccccc21,CCO,500.0
CCN1C(=CC2=C([O-])/C(=C\C3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2ccc(C(=O)O)cc21,CCO,635.0
CCN1C(=CC2=C([O-])C(=CC3=[N+](CC)c4ccc5ccccc5c4C3(C)C)C2=O)C(C)(C)c2c1ccc1ccccc21,ClC(Cl)Cl,665.5
CCN1C(=CC2=C([O-])C(=CC3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2c1ccc1ccccc21,ClC(Cl)Cl,650.0
CCN1C(=CC2=C([O-])C(=CC3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2ccccc21,CO,628.0
CCN1C(=CC2=C([O-])C(=CC3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,635.0
CCN1C(=CC2=C([O-])C(=CC3=[N+](CC)c4ccccc4C3(C)C)C2=O)C(C)(C)c2ccccc21,ClCCl,637.0
CCN1C(=CC2=C([O-])C(=Cc3[se]c4ccccc4[n+]3CC)C2=O)[Se]c2ccccc21,CO,665.0
CCN1C(=CC2=C([O-])C(=Cc3[se]c4ccccc4[n+]3CC)C2=O)[Se]c2ccccc21,ClC(Cl)Cl,684.0
CCN1C(=CC2=C([O-])C(=Cc3[se]c4ccccc4[n+]3CC)C2=O)[Se]c2ccccc21,ClCCl,686.0
CCN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3CC)C2=O)Sc2ccccc21,CO,649.0
CCN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3CC)C2=O)Sc2ccccc21,ClC(Cl)Cl,669.0
CCN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3CC)C2=O)Sc2ccccc21,ClCCl,670.0
CCN1C(=CC=Cc2sc3ccccc3[n+]2CC)Sc2ccccc21,CCO,559.0
CCN1C(=O)/C(=C/C=C2/Sc3ccccc3N2CC(=O)O)SC1=S,CCO,520.0
CCN1C(=O)/C(=c2\c(=Cc3ccc4c(c3)C3CCCC3N4c3ccc(CO)cc3)sc(=O)n2CC(=O)O)SC1=S,CS(C)=O,542.0
CCN1C(=O)/C(=c2\c(=Cc3ccc4c(c3)C3CCCC3N4c3ccc(CO)cc3)sc(=O)n2CCC(=O)O)SC1=S,CS(C)=O,541.0
CCN1C(=O)/C(=c2\c(=Cc3ccc4c(c3)C3CCCC3N4c3ccc(CO)cc3)sc(=O)n2CCCC(=O)O)SC1=S,CS(C)=O,542.0
CCN1C(=O)/C(=c2\s/c(=C/c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C=C(c5ccccc5)c5ccccc5)cc4)s3)c(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,571.0
CCN1C(=O)/C(=c2\s/c(=C/c3ccc(-c4ccc5c(c4)N(c4ccc(C=C(c6ccccc6)c6ccccc6)cc4)CC5)s3)c(=O)n2CC(=O)O)SC1=S,ClCCl,335.0
CCN1C(=O)/C(=c2\s/c(=C\c3cc4c(c5ccccc35)N(c3ccc(C=C(c5ccccc5)c5ccccc5)cc3)C3CCCC43)c(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,578.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4cc(OC)ccc4c3-c3c(O)ccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,521.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4cc(OC)ccc4c3-c3c(OC(C)C)ccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,550.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4cc(OC)ccc4c3-c3cccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,543.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4cc([N+](=O)[O-])ccc4c3-c3c(O)ccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,500.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4cc([N+](=O)[O-])ccc4c3-c3c(OC(C)C)ccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,509.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4cc([N+](=O)[O-])ccc4c3-c3cccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,505.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4ccccc4c3-c3c(O)ccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,519.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4ccccc4c3-c3c(OC(C)C)ccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,537.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4ccccc4c3-c3cccc4ccccc34)c(=O)n2CCC(=O)O)SC1=S,CS(C)=O,535.0
CCN1C(=O)/C(=c2\s/c(=C\c3ccc4sc(-c5ccc6c(c5)CCN6c5ccc(C=C(c6ccccc6)c6ccccc6)cc5)nc4c3)c(=O)n2CC(=O)O)SC1=S,ClCCl,390.0
CCN1C(=O)/C(=c2\s/c(=c3/c(=Cc4ccc5c(c4)C4CCCC4N5c4ccc(C=C(c5ccccc5)c5ccccc5)cc4)sc(=O)n3CC(=O)O)c(=O)n2CC)SC1=S,ClC(Cl)Cl,573.0
CCN1C(=O)C(=CC=C2N(c3ccccc3)c3ccccc3N2c2ccccc2)C(=O)N(CC)C1=S,CCO,481.0
CCN1C(=O)C(=CC=CC2=C3N(CCC2)c2ccccc2C3(C)C)C(=O)N(CC)C1=S,CCO,599.0
CCN1C(=O)C(=CC=CC=C2N(c3ccccc3)c3ccccc3N2c2ccccc2)C(=O)N(CC)C1=S,CCO,587.0
CCN1C(=O)C(=CC=CC=CC2=C3N(CCC2)c2ccccc2C3(C)C)C(=O)N(CC)C1=S,CCO,702.0
CCN1C(=O)C(=CC=CC=CC=c2c3cccc4cccc(c43)n2Cc2ccccc2)C(=O)N(CC)C1=S,Cc1ccccc1,806.0
CCN1C(=O)C(=CC=CC=c2c3cccc4cccc(c43)n2Cc2ccccc2)C(=O)N(CC)C1=S,Cc1ccccc1,707.0
CCN1C(=O)C(=CC=c2c3cccc4cccc(c43)n2Cc2ccccc2)C(=O)N(CC)C1=S,CCO,613.0
CCN1C(=O)C(=Cc2ccc(-c3sc(N(c4ccccc4)c4ccccc4)nc3-c3ccccc3)s2)C(=O)N(CC)C1=S,C1CCOC1,552.0
CCN1C(=O)C(=Cc2ccc(-c3sc(N(c4ccccc4)c4ccccc4)nc3-c3ccccc3)s2)C(=O)N(CC)C1=S,CC#N,548.0
CCN1C(=O)C(=Cc2ccc(-c3sc(N(c4ccccc4)c4ccccc4)nc3-c3ccccc3)s2)C(=O)N(CC)C1=S,CCCCCC,554.0
CCN1C(=O)C(=Cc2ccc(-c3sc(N(c4ccccc4)c4ccccc4)nc3-c3ccccc3)s2)C(=O)N(CC)C1=S,CS(C)=O,558.0
CCN1C(=O)C(=Cc2ccc(-c3sc(N(c4ccccc4)c4ccccc4)nc3-c3ccccc3)s2)C(=O)N(CC)C1=S,Cc1ccccc1,560.0
CCN1C(=O)C(=Cc2ccc(-c3sc(N(c4ccccc4)c4ccccc4)nc3-c3ccccc3)s2)C(=O)N(CC)C1=S,ClCCl,566.0
CCN1C(=O)C(=Cc2ccc(N(C)CCO)cc2)C(=O)N(CC)C1=S,CN(C)C=O,504.0
CCN1C(=O)C(C2C(=O)c3c4ccccc4cc4cc5ccccc5c2c34)C(=O)N(CC)C1=S,ClCCl,532.1074139
CCN1C(=O)C(C2C(=O)c3c4ccccc4cc4cc5ccccc5c2c34)SC1=S,ClCCl,510.1576182
CCN1CCCc2cc3c(cc21)C(C)(C)c1cc2c(cc1=C3)C(C)=CC(C)(C)[N+]=2CC,CCO,647.0
CCN1CCCc2cc3c(cc21)C(C)(C)c1cc2c(cc1=C3)CCC[N+]=2CC,CCO,626.0
CCN1CCCc2cc3c(cc21)C(C)(C)c1cc2c(cc1=C3c1ccccc1C(=O)[O-])CCC[N+]=2CC,CCO,632.0
CCN1CCCc2cc3c(cc21)Oc1cc2c(cc1=N3)C(CS(=O)(=O)[O-])CC(C)(C)[N+]=2CCCC(=O)[O-],O,655.0
CCN1CCN(CC)c2cc3oc(=O)c(-c4nc5ccccc5[nH]4)cc3cc21,CO,487.0
CCN1CCN(CC)c2cc3oc(=O)c(-c4nc5ccccc5s4)cc3cc21,CO,501.0
CCN1CCN(CC)c2cc3oc(=O)c(C#N)cc3cc21,CO,495.0
CCN1CCN(CC)c2cc3oc(=O)c(C(=O)C=Cc4ccccc4)cc3cc21,CCCCCC,514.0
CCN1CCN(CC)c2cc3oc(=O)c(C(N)=O)cc3cc21,CO,462.0
CCN1CCN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)CC1,CCO,612.0
CCN1CCN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)CC1,ClC(Cl)Cl,619.0
CCN1CCN(c2ccc(/N=N/c3cc(C(=O)OC)cc(C(=O)OC)c3)cc2)CC1,CCOC(C)=O,416.0
CCN1CCN(c2ccc(/N=N/c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)CC1,CCOC(C)=O,427.0
CCN1CCN(c2ccc(/N=N/c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)cc2)CC1,CCOC(C)=O,454.0
CCN1CCN(c2ccc(/N=N/c3ccc(C#N)cc3)cc2)CC1,CCOC(C)=O,428.0
CCN1CCN(c2ccc(/N=N/c3ccc(C(=O)OC)cc3)cc2)CC1,CCOC(C)=O,419.0
CCN1CCN(c2ccc(/N=N/c3ccc([N+](=O)[O-])cc3)cc2)CC1,CCOC(C)=O,448.0
CCN1CCO[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21,ClCCl,411.0
CCN1CCc2cc3c(cc21)C(C)(C)c1cc2c(cc1=C3)CC[N+]=2CC,CCO,633.0
CCN1O/C(=c2\c(=Cc3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C#N)cc4)cc3)sc(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,516.0
CCN1O/C(=c2\c(=Cc3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(N(C)C)cc4)cc3)sc(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,555.0
CCN1O/C(=c2\c(=Cc3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)sc(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,549.0
CCN1O/C(=c2\c(=Cc3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(OC)cc4)cc3)sc(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,546.0
CCN1O/C(=c2\c(=Cc3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccccc4)cc3)sc(=O)n2CC(=O)O)SC1=S,ClC(Cl)Cl,538.0
CCN1c2cc(C)sc2C(C)(C)C12C=Cc1cc([N+](=O)[O-])ccc1O2,Cc1ccccc1,613.0
CCN1c2cc3[o+]c(-c4ccccc4)cc(/C=C/C=C4\N(CCCCCC(=O)O)c5ccc(S(=O)(=O)[O-])cc5C4(C)C)c3cc2C(C)=CC1(C)C,CCO,675.0
CCN1c2cc3[o+]c(-c4ccccc4)cc(/C=C/C=C4\N(CCCS(=O)(=O)[O-])c5ccc(S(=O)(=O)[O-])cc5C4(C)CCCC(=O)O)c3cc2C(C)=CC1(C)C,CCO,675.0
CCN1c2cc3[o+]c(-c4ccccc4)cc(C=C/C=C/C=C4\N(CCCS(=O)(=O)[O-])c5ccc(S(=O)(=O)[O-])cc5C4(C)CCCC(=O)O)c3cc2C(C)=CC1(C)C,CCO,772.0
CCN1c2cc3[o+]c(C(C)(C)C)cc(/C=C/C=C/C=C4\N(CCCCCC(=O)O)c5ccc(S(=O)(=O)[O-])cc5C4(C)C)c3cc2C(C)=CC1(C)C,CCO,751.0
CCN1c2cc3[o+]c(C(C)(C)C)cc(/C=C/C=C/C=C4\N(CCCS(=O)(=O)[O-])c5ccc(S(=O)(=O)[O-])cc5C4(C)CCCC(=O)O)c3cc2C(C)=CC1(C)C,CCO,752.0
CCN1c2cc3[o+]c(C(C)(C)C)cc(/C=C/C=C4\N(CCCCCC(=O)O)c5ccc(S(=O)(=O)O)cc5C4(C)C)c3cc2C(C)=CC1(C)C,CCO,656.0
CCN1c2cc3[o+]c(C(C)(C)C)cc(/C=C/C=C4\N(CCCCCC(=O)O)c5ccc(S(=O)(=O)[O-])cc5C4(C)C)c3cc2C(C)=CC1(C)C,CCO,656.0
CCN1c2cc3[o+]c(C(C)(C)C)cc(/C=C/C=C4\N(CCCS(=O)(=O)[O-])c5ccc([SH](=O)([O-])O)cc5C4(C)CCCC(=O)O)c3cc2C(C)=CC1(C)C,CCO,655.0
CCN1c2cc3[o+]c4c(c(-c5ccccc5C(=O)N(C)CCS(=O)(=O)[O-])c3cc2C(CS(=O)(=O)[O-])=CC1(C)C)CCC/C4=C\C=C\C=C1\N(CCCCCC(=O)O)c2ccc(S(=O)(=O)[O-])cc2C1(C)C,CCO,847.0
CCN1c2cc3c(cc2C(C)=CC1(C)C)C(c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)[O-])=c1cc2c(cc1C3(C)C)=[N+](CC)CCC2,CCO,683.0
CCN1c2cc3c(cc2C(C)=CC1(C)C)C(c1ccccc1C(=O)[O-])=c1cc2c(cc1C3(C)C)=[N+](CC)C(C)(C)C=C2C,CCO,670.0
CCN1c2cc3c(cc2C(C)=CC1(C)C)C(c1ccccc1C(=O)[O-])=c1cc2c(cc1C3(C)C)=[N+](CC)CCC2,CCO,653.0
CCN1c2cc3c(cc2C(C)=CC1(C)C)C=c1cc2c(cc1C3(C)C)=[N+](CC)C(C)(C)C=C2C,CCO,664.0
CCN1c2cc3oc4cc(=[N+](CC)CC)ccc-4c(-c4ccccc4C(=O)[O-])c3cc2N(CC)C2CCCCC21,CCO,584.0
CCN1c2cc3oc4cc(=[NH2+])ccc-4c(-c4ccccc4C(=O)[O-])c3cc2N(CC)C2CCCCC21,CCO,565.0
CCN1c2ccc(-c3cc(-c4ccccc4)[nH]n3)cc2Sc2cc(-c3cc(-c4ccccc4)[nH]n3)ccc21,C1CCOC1,338.0
CCN1c2ccc(-c3cc(-c4ccccc4)[nH]n3)cc2Sc2cc(-c3cc(-c4ccccc4)[nH]n3)ccc21,CC#N,338.0
CCN1c2ccc(-c3cc(-c4ccccc4)[nH]n3)cc2Sc2cc(-c3cc(-c4ccccc4)[nH]n3)ccc21,CN(C)C=O,336.0
CCN1c2ccc(-c3cc(-c4ccccc4)[nH]n3)cc2Sc2cc(-c3cc(-c4ccccc4)[nH]n3)ccc21,ClCCl,336.0
CCN1c2ccc(-c3cc(-c4ccccc4)[nH]n3)cc2Sc2cc(-c3cc(-c4ccccc4)[nH]n3)ccc21,c1ccccc1,338.0
CCN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2CCc2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc21,CN(C)C=O,445.0
CCN1c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2Sc2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)ccc21,CN(C)C=O,489.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(C#N)cc3)ccc21,C1CCOC1,383.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(C#N)cc3)ccc21,CS(C)=O,398.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(C#N)cc3)ccc21,Cc1ccccc1,386.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(C#N)cc3)ccc21,ClCCl,388.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(OC)cc3)ccc21,C1CCOC1,381.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(OC)cc3)ccc21,CS(C)=O,386.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(OC)cc3)ccc21,Cc1ccccc1,380.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccc(OC)cc3)ccc21,ClCCl,383.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3cccc4ccccc34)ccc21,C1CCOC1,378.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3cccc4ccccc34)ccc21,CS(C)=O,383.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3cccc4ccccc34)ccc21,Cc1ccccc1,378.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3cccc4ccccc34)ccc21,ClCCl,379.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccccc3)ccc21,C1CCOC1,379.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccccc3)ccc21,CS(C)=O,387.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccccc3)ccc21,Cc1ccccc1,382.0
CCN1c2ccc(/C=N/Nc3ccccn3)cc2Sc2cc(-c3ccccc3)ccc21,ClCCl,384.0
CCN1c2ccc(C(F)(F)F)cc2C(C)(C)C12CCc1cc([N+](=O)[O-])ccc1O2,CC#N,205.0
CCN1c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2CCc2cc(C=C3SC(=S)N(CC(=O)O)C3=O)ccc21,CN(C)C=O,445.0
CCN1c2ccccc2CCc2cc(/C=C(\C#N)C(=O)O)ccc21,CC#N,368.0
CCN1c2ccccc2Sc2cc(-c3ccc(-c4nc(-c5ccc(-c6ccc7c(c6)Sc6ccccc6N7CC)cc5)nc(-c5ccc(-c6ccc7c(c6)Sc6ccccc6N7CC)cc5)n4)cc3)ccc21,C1CCOC1,403.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,C1CCOC1,439.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21,CC#N,400.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)c3ccccc3)ccc21,C1CCOC1,411.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)c3ccccc3)ccc21,CC#N,409.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)c3ccccc3)ccc21,CC(C)=O,410.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)c3ccccc3)ccc21,CN(C)C=O,414.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)c3ccccc3)ccc21,CS(C)=O,418.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)c3ccccc3)ccc21,Cc1ccccc1,412.0
CCN1c2ccccc2Sc2cc(/C=C(\C#N)c3ccccc3)ccc21,ClCCl,413.0
CCN1c2ccccc2Sc2cc(/C=C/C(=O)O)ccc21,CC#N,381.0
CCN1c2ccccc2Sc2cc(/C=C/c3sc(/C=C(\C#N)C(=O)O)c4c3OCCO4)ccc21,CN(C)C=O,473.0
CCN1c2ccccc2Sc2cc(C=CC(=O)O)ccc21,CC#N,381.0
CCN=C=S,CCCCCC,250.0
CCNc1c2ccc(=[N+](CC)CC)cc-2oc2cc(N(CC)CC)ccc12,O,460.0
CCNc1cc2c(cc1C)C(/C=C1/N(CC)c3ccccc3C1(C)C)=C1CCCC(/C=C/C3=[N+](CC)c4ccc5ccccc5c4C3(C)C)=C1O2,ClCCl,710.0
CCNc1cc2c(cc1C)C(/C=C1/N(CC)c3ccccc3C1(C)C)=C1CCCC(/C=C/C3=[N+](CC)c4ccccc4C3(C)C)=C1O2,ClCCl,710.0
CCNc1cc2c(cc1C)C(c1ccccc1C(=O)O)=C1CCCC(/C=C/C3=[N+](C)c4ccccc4C3(C)C)=C1O2,CC#N,696.0
CCNc1cc2c(cc1C)C(c1ccccc1C(=O)O)=C1CCCC(/C=C/C3=[N+](C)c4ccccc4C3(C)C)=C1O2,CCO,688.0
CCNc1cc2c(cc1C)C(c1ccccc1C(=O)O)=C1CCCC(/C=C/C3=[N+](C)c4ccccc4C3(C)C)=C1O2,CO,690.0
CCNc1cc2c(cc1C)C(c1ccccc1C(=O)O)=C1CCCC(/C=C/C3=[N+](C)c4ccccc4C3(C)C)=C1O2,ClC(Cl)Cl,702.0
CCNc1cc2c(cc1C)C(c1ccccc1C(=O)[O-])=c1cc3c4c(c1O2)CCC[N+]=4CCC3,O,554.0
CCNc1cc2oc(=O)c3c(=O)oc4ccccc4c3c2cc1C,CS(C)=O,454.0
CCNc1cc2oc(=O)c3c(=O)oc4ccccc4c3c2cc1C,ClCCl,441.0
CCNc1cc2oc(=O)cc(C(F)(F)F)c2cc1C,CC#N,383.0
CCNc1cc2oc(=O)cc(C)c2cc1C,CC#N,354.0
CCNc1cc2oc3c(ccc4cc(=O)ccc43)c(-c3ccccc3C(=O)O)c2cc1C,O,552.0
CCNc1cc2oc3c/c(=[NH+]/CC)c(C)cc-3c(-c3ccc(C(=O)ON4C(=O)C=CC4=O)cc3C(=O)[O-])c2cc1C,CO,524.0
CCNc1cc2oc3c/c(=[NH+]/CC)c(C)cc-3c(-c3ccccc3C(=O)[O-])c2cc1C,O,521.0
CCNc1cc2oc3c/c(=[NH+]/CC)ccc-3c(-c3ccccc3C(=O)[O-])c2cc1C,O,539.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,C1CCCCC1,643.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,C1COCCO1,642.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CC(C)=O,640.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CCCCCCCCCCO,647.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CCCCCCCO,646.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CCCCCCO,645.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CCCCO,644.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CCO,641.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CN(C)C=O,641.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CO,639.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,CS(C)=O,644.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,ClC(Cl)(Cl)Cl,646.0
CCNc1ccc(NCC)c2c1C(=O)c1ccccc1C2=O,c1ccccc1,646.0
CCNc1ccc2c(-c3cc(C(=O)ON4C(=O)C=CC4=O)ccc3C(=O)[O-])c3cc/c(=[NH+]\CC)cc-3oc2c1,CO,524.0
CCNc1ccc2c(-c3cc(C)cc(C)c3)c3ccc(=[NH2+])cc-3oc2c1,O,515.0
CCNc1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,510.0
CCNc1ccc2c(-c3ccc(F)c(C)c3)c3ccc(=[NH2+])cc-3oc2c1,O,515.0
CCNc1ccc2c(-c3ccc(OC)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,510.0
CCNc1ccc2c(-c3ccc(Oc4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,500.0
CCNc1ccc2c(-c3ccc4ccccc4c3)c3ccc(=[NH2+])cc-3oc2c1,O,510.0
CCNc1ccc2c(-c3cccc(Cl)c3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CCNc1ccc2c(-c3cccc(F)c3)c3ccc(=[NH2+])cc-3oc2c1,O,520.0
CCNc1ccc2c(-c3cccc(OC)c3)c3ccc(=[NH2+])cc-3oc2c1,O,515.0
CCNc1ccc2c(-c3ccccc3)c3ccc(=[NH2+])cc-3oc2c1,O,510.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,C1CCC2CCCCC2C1,365.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,C1CCCCC1,364.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC#N,385.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC(C)=O,388.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC(C)O,392.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC1CCCCC1,364.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCC(C)CC,361.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCC(C)C,360.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCCCC,360.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCCCCO,392.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCCO,391.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCO,394.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCOC(C)=O,382.0
CCNc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CO,392.0
CCNc1ccc2c(c1)C(C)(C)C(=O)C=C2,O,402.0
CCNc1ccc2c(c1)Cc1c-2[o+]c2cc(N(CC)CC)ccc2c1-c1ccccc1C(=O)[O-],CCO,573.0
CCNc1ccc2c(c1)OC1=C(/C=C/C3=[N+](CC)c4ccc5ccccc5c4C3(C)C)CCCC1=C2/C=C1/N(CC)c2ccccc2C1(C)C,ClCCl,712.0
CCNc1ccc2c(c1)OC1=C(/C=C/C3=[N+](CC)c4ccccc4C3(C)C)CCCC1=C2/C=C1/N(CC)c2ccccc2C1(C)C,ClCCl,712.0
CCNc1ccc2nc3cc/c(=[NH+]\CC)cc-3oc2c1,CO,589.0
CCNc1cccc2c1C(=O)c1ccccc1C2=O,ClCCl,510.0
CCOC(=O)/C(=C/c1ccc(N(C)C)cc1)n1nc2ccccc2n1,CO,391.0
CCOC(=O)/C(=C/c1ccc(N(C)C)cc1)n1nnc2ccccc21,CO,390.0
CCOC(=O)/C(=C/c1ccc(N(CC)CC)cc1)n1nc2ccccc2n1,CO,399.0
CCOC(=O)/C(=C/c1ccc(N(CC)CC)cc1)n1nnc2ccccc21,CO,398.0
CCOC(=O)/C(=C/c1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1)c1nnn[nH]1,ClCCl,423.0
CCOC(=O)/C(=C/c1ccc(N(c2ccc(N3c4ccccc4Sc4ccccc43)cc2)c2ccc(N3c4ccccc4Sc4ccccc43)cc2)cc1)c1nnn[nH]1,ClCCl,418.0
CCOC(=O)/C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1nnn[nH]1,ClCCl,422.0
CCOC(=O)/C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)n1nc2ccccc2n1,CO,398.0
CCOC(=O)/C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)n1nnc2ccccc21,CO,398.0
CCOC(=O)/C(=C/c1ccc(N2CCOCC2)cc1)n1nc2ccccc2n1,CO,372.0
CCOC(=O)/C(=C1\C(=O)C(O)=C1C=C1N(C)c2ccccc2C1(C)C)[N+](=O)[O-],CCO,475.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,C1COCCO1,474.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,CC#N,487.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,CC(C)=O,484.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,CCO,493.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,CCOC(C)=O,481.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,CN(C)C=O,496.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,CO,493.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,ClC(Cl)Cl,502.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccc(/C=C/C(=C(/C#N)C(=O)OCC)c3ccccc3)cc2)cc1)c1ccccc1,ClCCl,481.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CC#N,457.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CC(C)=O,457.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CCO,466.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CCOC(C)=O,454.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CN(C)C=O,466.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CO,463.0
CCOC(=O)/C(C#N)=C(\C=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,ClC(Cl)Cl,475.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,C1CCOC1,407.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,CC#N,410.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,CCOC(C)=O,406.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,CN(C)C=O,417.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,CO,415.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,CS(C)=O,419.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,Cc1ccccc1,407.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,ClC(Cl)Cl,415.0
CCOC(=O)/C(C#N)=C/c1cc2c3ccccc3n(C)c2cc1OC,ClCCl,412.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,C1CCOC1,347.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,C1COCCO1,348.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,CCO,347.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,CCOC(C)=O,346.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,CN(C)C=O,347.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,CO,344.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,CS(C)=O,349.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,Cc1ccccc1,353.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,ClC(Cl)Cl,351.0
CCOC(=O)/C(C#N)=C\c1cn(-c2ccccc2)nc1-c1ccccc1,ClCCl,348.0
CCOC(=O)/C(C)=C/C1=C(c2ccc(C)cc2)C2=Nc3c(-c4ccc(C)cc4)c(-c4ccc(OC)cc4)c(-c4ccc(C)cc4)n3[B-](F)(F)[N+]2=C1c1ccc(C)cc1,ClC(Cl)Cl,670.0
CCOC(=O)/C(C)=C/C1=C(c2ccc(C)cc2)C2=Nc3c(-c4ccc(C)cc4)c(Br)c(-c4ccc(C)cc4)n3[B-](F)(F)[N+]2=C1c1ccc(C)cc1,ClC(Cl)Cl,661.0
CCOC(=O)/C=C/C1=C(c2ccc(C)cc2)C2=Nc3c(-c4ccc(C)cc4)c(-c4ccc(OC)cc4)c(-c4ccc(C)cc4)n3[B-](F)(F)[N+]2=C1c1ccc(C)cc1,ClC(Cl)Cl,673.0
CCOC(=O)/C=C/C1=C(c2ccc(C)cc2)C2=Nc3c(-c4ccc(C)cc4)c(Br)c(-c4ccc(C)cc4)n3[B-](F)(F)[N+]2=C1c1ccc(C)cc1,ClC(Cl)Cl,666.0
CCOC(=O)/C=C/C1=C(c2ccc(C)cc2)C2=Nc3c(-c4ccc(C)cc4)cc(-c4ccc(C)cc4)n3[B-](F)(F)[N+]2=C1c1ccc(C)cc1,ClC(Cl)Cl,663.0
CCOC(=O)/C=C/C1=[N+]2C(=C(c3c(C)cc(C)cc3C)c3ccc(/C=C/C(=O)OCC)n3[B-]2(F)F)C=C1,ClCCl,593.0
CCOC(=O)/C=C/c1cc(-c2ccc(N(C)C)c(/C=C/C(=O)OCC)c2)ccc1N(C)C,ClCCl,367.0
CCOC(=O)/C=C/c1cc2ccc(-c3cn(Cc4ccccc4)nn3)cc2oc1=O,CCO,358.0
CCOC(=O)/C=C/c1cc2ccc(O)cc2oc1=O,CCO,367.0
CCOC(=O)/C=C/c1ccc(-c2ccc(/C=C/C(=O)OCC)c(N(C)C)c2)cc1N(C)C,ClCCl,384.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,C1CCCCC1,353.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,C1CCOC1,362.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,C1COCCO1,359.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CC#N,363.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CCCCCCCCO,363.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CCCCCCO,365.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CCCCO,363.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CCCO,364.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CCO,363.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CCOC(C)=O,360.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,CO,362.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,Cc1ccccc1,362.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,O,373.0
CCOC(=O)/C=C/c1ccc(N(C)C)cc1,c1ccccc1,363.0
CCOC(=O)/N=c1/oc2cc(OC)cc(OC)c2cc1C#N,ClCCl,376.0
CCOC(=O)/N=c1/oc2cc(OC)ccc2cc1C#N,ClCCl,370.0
CCOC(=O)/N=c1/oc2ccc(OC)cc2cc1C#N,ClCCl,388.0
CCOC(=O)C(=Cc1ccc(N(c2ccccc2)c2ccc(C=C(C(=O)OCC)c3nnn[nH]3)cc2)cc1)c1nnn[nH]1,ClCCl,445.0
CCOC(=O)C(C#N)=C1C=C(C)CC(C)(C)C1,CO,625.0
CCOC(=O)C(C#N)=C1c2ccccc2-c2c1sc(N)c2C#N,CC(C)=O,599.0
CCOC(=O)C(C#N)=CNc1cccc(F)c1,CS(C)=O,321.0
CCOC(=O)C(C#N)=Cc1cn(CC)c2ccccc12,Cc1ccccc1,393.0
CCOC(=O)C(C(=O)OCC)C1=[N+]2C(=C(c3ccc(C)cc3)c3ccc(C(C(=O)OCC)C(=O)OCC)n3[B-]2(F)F)C=C1,C1CCCCC1,515.0
CCOC(=O)C(C(=O)OCC)C1=[N+]2C(=C(c3ccc(C)cc3)c3ccc(C(C(=O)OCC)C(=O)OCC)n3[B-]2(F)F)C=C1,C1CCOC1,512.0
CCOC(=O)C(C(=O)OCC)C1=[N+]2C(=C(c3ccc(C)cc3)c3ccc(C(C(=O)OCC)C(=O)OCC)n3[B-]2(F)F)C=C1,CCOC(C)=O,510.0
CCOC(=O)C(C(=O)OCC)C1=[N+]2C(=C(c3ccc(C)cc3)c3ccc(C(C(=O)OCC)C(=O)OCC)n3[B-]2(F)F)C=C1,CO,509.0
CCOC(=O)C(C(=O)OCC)C1=[N+]2C(=C(c3ccc(C)cc3)c3ccc(C(C(=O)OCC)C(=O)OCC)n3[B-]2(F)F)C=C1,Cc1ccccc1,514.0
CCOC(=O)C(C(=O)OCC)C1=[N+]2C(=C(c3ccc(C)cc3)c3ccc(C(C(=O)OCC)C(=O)OCC)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,513.0
CCOC(=O)C(C=C(c1ccccc1)c1ccccc1)(CC)C(=O)OCC,CC#N,194.0
CCOC(=O)C(Cc1ccc(O[Si]2(Oc3ccc(CC(NC(C)=O)C(=O)OCC)cc3)n3c4c5ccccc5c3/N=C3\N=C(/N=c5/c6ccccc6/c(n52)=N/C2=N/C(=N\4)c4ccccc42)c2ccccc23)cc1)NC(C)=O,CN(C)C=O,681.0
CCOC(=O)C(Cc1ccccc1)NC(=O)[C@@H]1CSCCN1S(=O)(=O)c1ccc(C)cc1,CC#N,478.0
CCOC(=O)C(c1ccccc1)=[N+]([O-])c1ccccc1,ClCCl,620.0
CCOC(=O)C1(O)c2cc3ccc4cccc5ccc(c2C(=O)N1C(C)(C)C)c3c45,ClC(Cl)Cl,385.0
CCOC(=O)C1=C(C(=O)OC)N2CCc3cc(OC)c(OC)cc3C2=C[C@H](c2ccc(Cl)cc2)C12c1ccccc1-c1ccccc12,ClCCl,310.0
CCOC(=O)C1=C(C(=O)OCC)C2(c3cc(Cl)ccc3-c3ccc(Cl)cc32)C2(/C=C/c3ccccc3)c3cc(OC)c(OC)cc3CCN12,ClCCl,327.0
CCOC(=O)C1=C(C(=O)OCC)C2(c3ccccc3-c3c(Br)cc(Br)cc32)C2(/C=C/c3ccc(Cl)cc3)c3cc(OC)c(OC)cc3CCN12,ClCCl,329.0
CCOC(=O)C1=C(C(=O)OCC)C2(c3ccccc3-c3ccccc32)[C@@H](c2ccc(Cl)cc2)C=C2c3cc(OC)c(OC)cc3CCN21,ClCCl,311.0
CCOC(=O)C1=C(C(=O)OCC)C2(c3ccccc3-c3ccccc32)[C@@H](c2ccc([N+](=O)[O-])cc2)C=C2c3cc(OC)c(OC)cc3CCN21,ClCCl,310.0
CCOC(=O)C1=C(C(=O)OCC)C2(c3ccccc3-c3ccccc32)[C@@H](c2ccccc2)C=C2c3cc(OC)c(OC)cc3CCN21,ClCCl,311.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,C1CCOC1,374.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,C1COCCO1,373.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,CC#N,379.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,CCO,395.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,CN(C)C=O,385.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,CO,389.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,CS(C)=O,400.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,ClC(Cl)(Cl)Cl,371.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,ClC(Cl)Cl,383.0
CCOC(=O)C1=C(C)NC2=C(C(=O)c3ccccc32)C1c1ccc(N(C)C)cc1,ClCCl,387.0
CCOC(=O)C1=C(N)n2c(=O)c3ccccc3c(=O)n2C1c1ccc(C)cc1,CS(C)=O,365.0
CCOC(=O)C1=C(N)n2c(=O)c3ccccc3c(=O)n2C1c1cccs1,CS(C)=O,365.0
CCOC(=O)C1=C(c2ccc(-c3ccccc3)cc2)NC(=O)C1=CC1=CCC(=C=O)C=C1,CS(C)=O,441.0
CCOC(=O)C1=C(c2ccc(-c3ccccc3)cc2)NC(=O)C1=Cc1ccc(N(C)C)cc1,CS(C)=O,478.0
CCOC(=O)C1=C(c2ccc(-c3ccccc3)cc2)NC(=O)C1=Cc1cccc2ccccc12,CS(C)=O,427.0
CCOC(=O)C1=C(c2ccc(-c3ccccc3)cc2)NC(=O)C1=Cc1ccccc1,CS(C)=O,417.0
CCOC(=O)C1=C(c2ccc3ccccc3c2)NC(=O)C1=NNc1cc([N+](=O)[O-])ccc1O,C1CCOC1,555.0
CCOC(=O)C1=C(c2ccc3ccccc3c2)NC(=O)C1=NNc1ccc([N+](=O)[O-])cc1O,C1CCOC1,639.0
CCOC(=O)C1=C(c2ccc3ccccc3c2)NC(=O)C1=NNc1ccccc1O,C1CCOC1,466.0
CCOC(=O)C1=C(c2ccccc2)N(C)C(=O)C1=Cc1ccc(-c2cccs2)s1,CC1CCCO1,651.0
CCOC(=O)C1=C(c2ccccc2)N(C)C(=O)C1=Cc1cccs1,CC1CCCO1,537.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=CC1=CCC(=C=O)C=C1,CS(C)=O,433.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=Cc1ccc(N(C)C)cc1,CS(C)=O,471.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=Cc1cccc2ccccc12,CS(C)=O,419.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=Cc1ccccc1,CS(C)=O,412.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=Cc1cccs1,CC1CCCO1,544.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=NNc1cc([N+](=O)[O-])ccc1O,C1CCOC1,546.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=NNc1ccc([N+](=O)[O-])cc1O,C1CCOC1,624.0
CCOC(=O)C1=C(c2ccccc2)NC(=O)C1=NNc1ccccc1O,C1CCOC1,460.0
CCOC(=O)C1=CN(Cc2ccccc2)C=C(C(=O)OCC)C1,C1CCOC1,367.0
CCOC(=O)C1=CN(Cc2ccccc2)C=C(C(=O)OCC)C1,CO,371.0
CCOC(=O)C1=CN(c2ccccc2)C=C(C(=O)OCC)C1c1ccccc1,C1CCOC1,362.0
CCOC(=O)C1=CN(c2ccccc2)C=C(C(=O)OCC)C1c1ccccc1,CO,366.0
CCOC(=O)C1=CN(c2ccccc2)C=CC1c1ccccc1,C1CCOC1,344.0
CCOC(=O)C1=CN(c2ccccc2)C=CC1c1ccccc1,CO,348.0
CCOC(=O)C1=CNC=C(C(=O)OCC)C1c1ccccc1,C1CCOC1,355.0
CCOC(=O)C1=CNC=C(C(=O)OCC)C1c1ccccc1,CO,355.0
CCOC(=O)C1CC(C#N)=C2C=CC=NN21,C1CCCCC1,508.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,C1CCOC1,368.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,C1COCCO1,370.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,CC#N,366.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,CCCCCCC,368.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,CCO,370.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,O,375.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,OCC(O)CO,370.0
CCOC(=O)C1CC(c2c(C#N)c(C)nn2-c2ccccc2)=CN1c1ccc(Br)cc1,OCCO,370.0
CCOC(=O)C1c2cc(Cl)ccc2C(=O)N1c1ccc(OC)c(OC)c1,CCCCCC,295.0
CCOC(=O)C1c2cc(Cl)ccc2C(=O)N1c1ccc(OC)c(OC)c1,CO,294.0
CCOC(=O)C1c2cc(Cl)ccc2C(=O)N1c1ccc(OC)c(OC)c1,CS(C)=O,308.0
CCOC(=O)C1c2cc(Cl)ccc2C(=O)N1c1ccc(OC)c(OC)c1,ClCCl,300.0
CCOC(=O)C1c2cc(OC)c(OC)cc2C(=O)N1c1ccc(OC)c(OC)c1,CCCCCC,299.0
CCOC(=O)C1c2cc(OC)c(OC)cc2C(=O)N1c1ccc(OC)c(OC)c1,CO,303.0
CCOC(=O)C1c2cc(OC)c(OC)cc2C(=O)N1c1ccc(OC)c(OC)c1,CS(C)=O,302.0
CCOC(=O)C1c2cc(OC)c(OC)cc2C(=O)N1c1ccc(OC)c(OC)c1,ClCCl,303.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccc(OC)cc1,CCCCCC,283.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccc(OC)cc1,CO,298.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccc(OC)cc1,CS(C)=O,300.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccc(OC)cc1,ClCCl,297.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccc1,CCCCCC,282.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccc1,CO,282.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccc1,CS(C)=O,286.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccc1,ClCCl,284.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccn1,CCCCCC,310.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccn1,CO,324.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccn1,CS(C)=O,333.0
CCOC(=O)C1c2ccccc2C(=O)N1c1ccccn1,ClCCl,314.0
CCOC(=O)CCCCCn1c2ccc(C)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(C)ccc1n3CCCCCC(=O)OCC,CO,540.0
CCOC(=O)CCCCCn1c2ccc(Cl)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(Cl)ccc1n3CCCCCC(=O)OCC,CO,534.0
CCOC(=O)CCCCCn1c2ccc(N)cc2c(=O)c2cc(N)ccc21,O,455.0
CCOC(=O)CCCCCn1c2ccc(N)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(N)ccc1n3CCCCCC(=O)OCC,ClCCl,574.0
CCOC(=O)CCCCCn1c2ccc(OC)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(OC)ccc1n3CCCCCC(=O)OCC,CCO,555.0
CCOC(=O)CCCCCn1c2ccc([N+](=O)[O-])cc2c(=O)c2cc([N+](=O)[O-])ccc21,CCO,387.0
CCOC(=O)CCCCCn1c2ccc([N+](=O)[O-])cc2c(=O)c2cc3c(cc21)c(=O)c1cc([N+](=O)[O-])ccc1n3CCCCCC(=O)OCC,ClCCl,506.0
CCOC(=O)CCCCCn1c2ccccc2c(=O)c2cc(N)ccc21,O,405.0
CCOC(=O)CCCCCn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1cc(I)ccc1n3CCCCCC(=O)OCC,CO,535.0
CCOC(=O)CCCCCn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1ccccc1n3CC,CO,528.0
CCOC(=O)CCCCCn1c2ccccc2c(=O)c2cc3c(cc21)c(=O)c1ccccc1n3CCCCCC(=O)OCC,CO,527.0
CCOC(=O)CCOc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1,C1CCCCC1,290.0
CCOC(=O)CCOc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1OC,C1CCCCC1,291.0
CCOC(=O)CCOc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1OC,CC#N,289.0
CCOC(=O)CCOc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1OC,CO,289.0
CCOC(=O)CCOc1ccccc1C(c1c(C)[nH]c2ccccc12)c1c(C)[nH]c2ccccc12,CO,291.0
CCOC(=O)CCOc1ccccc1C(c1c(C)[nH]c2ccccc12)c1c(C)[nH]c2ccccc12,O,290.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,CC#N,620.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,CO,618.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,ClCCl,638.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,O,610.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2ccc(N(C)C)cc2oc1=O)O3,CC#N,593.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2ccc(N(C)C)cc2oc1=O)O3,CO,591.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2ccc(N(C)C)cc2oc1=O)O3,ClCCl,606.0
CCOC(=O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2ccc(N(C)C)cc2oc1=O)O3,O,587.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,CC#N,328.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,CCOC(C)=O,328.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,CN(C)C=O,332.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,CS(C)=O,336.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,c1ccccc1,328.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccncc3)nc(-c3ccncc3)c2)cc1,CC#N,334.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccncc3)nc(-c3ccncc3)c2)cc1,CCOC(C)=O,334.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccncc3)nc(-c3ccncc3)c2)cc1,CN(C)C=O,342.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccncc3)nc(-c3ccncc3)c2)cc1,CS(C)=O,344.0
CCOC(=O)CN(CC(=O)OCC)c1ccc(-c2cc(-c3ccncc3)nc(-c3ccncc3)c2)cc1,c1ccccc1,332.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(C#N)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(C#N)cc1,CC#N,473.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(C#N)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(C#N)cc1,CS(C)=O,480.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(C#N)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(C#N)cc1,Cc1ccccc1,482.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(C#N)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,CC#N,464.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(C#N)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,CS(C)=O,471.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(C#N)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,Cc1ccccc1,472.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(C#N)cc1,CC#N,524.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(C#N)cc1,CS(C)=O,541.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(C#N)cc1,Cc1ccccc1,527.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(N2CCCCC2)cc1,CC#N,523.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(N2CCCCC2)cc1,CS(C)=O,540.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccc(N2CCCCC2)cc1,Cc1ccccc1,520.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,CC#N,500.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,CS(C)=O,516.0
CCOC(=O)CN1C(=O)C2=C(c3ccc(N4CCCCC4)cc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,Cc1ccccc1,499.0
CCOC(=O)CN1C(=O)C2=C(c3ccccc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,CC#N,454.0
CCOC(=O)CN1C(=O)C2=C(c3ccccc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,CS(C)=O,460.0
CCOC(=O)CN1C(=O)C2=C(c3ccccc3)N(CC(=O)OCC)C(=O)C2=C1c1ccccc1,Cc1ccccc1,462.0
CCOC(=O)CNc1c(-c2cc(-c3ccc(Cl)cc3)n(C)n2)nc2ccc(Cl)cn12,ClC(Cl)Cl,330.08
CCOC(=O)CNc1c(-c2cc(-c3ccc(F)cc3)n(-c3ccccc3)n2)nc2ccc(Cl)cn12,ClC(Cl)Cl,332.0
CCOC(=O)COc1ccc(/C=C/C2=C3C(C)=CC(/C=C/c4ccc(OCC(=O)OCC)cc4)=[N+]3[B-](F)(F)n3c2c2ccccc2c3-c2[nH]c(C)cc2C)cc1,ClCCl,676.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4[nH]c(C)cc4C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,C1CCOC1,608.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4[nH]c(C)cc4C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CC#N,602.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4[nH]c(C)cc4C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CCCCCC,608.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4[nH]c(C)cc4C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,CO,603.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4[nH]c(C)cc4C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,Cc1ccccc1,614.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4[nH]c(C)cc4C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,ClCCl,608.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4ccc[nH]4)=[N+]3[B-](F)(F)n3ccc(C)c32)cc1,C1CCOC1,586.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4ccc[nH]4)=[N+]3[B-](F)(F)n3ccc(C)c32)cc1,CC#N,577.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4ccc[nH]4)=[N+]3[B-](F)(F)n3ccc(C)c32)cc1,CCCCCC,587.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4ccc[nH]4)=[N+]3[B-](F)(F)n3ccc(C)c32)cc1,CO,580.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4ccc[nH]4)=[N+]3[B-](F)(F)n3ccc(C)c32)cc1,Cc1ccccc1,592.0
CCOC(=O)COc1ccc(/C=C/C2=C3c4ccccc4C(c4ccc[nH]4)=[N+]3[B-](F)(F)n3ccc(C)c32)cc1,ClCCl,585.0
CCOC(=O)COc1ccc(/C=C/C2=[N+]3C(=Cc4c5ccccc5c(-c5[nH]c(C)cc5C)n4[B-]3(F)F)C(C)=C2)cc1,ClCCl,680.0
CCOC(=O)COc1ccc(/C=C/c2c(CC)c(C)c3n2[B-](F)(F)[N+]2=C(c4[nH]c(C)c(CC)c4C)c4ccccc4C2=C3C)cc1,C1CCOC1,675.0
CCOC(=O)COc1ccc(/C=C/c2c(CC)c(C)c3n2[B-](F)(F)[N+]2=C(c4[nH]c(C)c(CC)c4C)c4ccccc4C2=C3C)cc1,CC#N,664.0
CCOC(=O)COc1ccc(/C=C/c2c(CC)c(C)c3n2[B-](F)(F)[N+]2=C(c4[nH]c(C)c(CC)c4C)c4ccccc4C2=C3C)cc1,CCCCCC,677.0
CCOC(=O)COc1ccc(/C=C/c2c(CC)c(C)c3n2[B-](F)(F)[N+]2=C(c4[nH]c(C)c(CC)c4C)c4ccccc4C2=C3C)cc1,CO,666.0
CCOC(=O)COc1ccc(/C=C/c2c(CC)c(C)c3n2[B-](F)(F)[N+]2=C(c4[nH]c(C)c(CC)c4C)c4ccccc4C2=C3C)cc1,Cc1ccccc1,682.0
CCOC(=O)COc1ccc(/C=C/c2c(CC)c(C)c3n2[B-](F)(F)[N+]2=C(c4[nH]c(C)c(CC)c4C)c4ccccc4C2=C3C)cc1,ClCCl,675.0
CCOC(=O)COc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1,C1CCCCC1,291.0
CCOC(=O)COc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1,CC#N,290.0
CCOC(=O)COc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1,CO,290.0
CCOC(=O)COc1ccc(C(c2c(C)[nH]c3ccccc23)c2c(C)[nH]c3ccccc23)cc1,O,289.0
CCOC(=O)CSc1nc(-c2ccc(OC)cc2)c(C)c(C#N)c1C#N,c1ccccc1,374.0
CCOC(=O)CSc1nc(-c2ccccc2)c(C)c(C#N)c1C#N,C1COCCO1,350.0
CCOC(=O)CSc1nc(-c2ccccc2)c(C)c(C#N)c1C#N,CC#N,365.0
CCOC(=O)CSc1nc(-c2ccccc2)c(C)c(C#N)c1C#N,CCO,367.0
CCOC(=O)CSc1nc(-c2ccccc2)c(C)c(C#N)c1C#N,CCOC(C)=O,366.0
CCOC(=O)CSc1nc(-c2ccccc2)c(C)c(C#N)c1C#N,ClC(Cl)Cl,376.0
CCOC(=O)CSc1nc(-c2ccccc2)c(C)c(C#N)c1C#N,c1ccccc1,372.0
CCOC(=O)CSc1nc(C)c(C)c(C#N)c1C#N,c1ccccc1,358.0
CCOC(=O)CSc1nc(C)c(CC)c(C#N)c1C#N,c1ccccc1,357.0
CCOC(=O)CSc1nc2c(c(C#N)c1C#N)CCCC2,c1ccccc1,364.0
CCOC(=O)CSc1nc2c(c(C#N)c1C#N)CCCCCC2,c1ccccc1,360.0
CCOC(=O)C[N+]1=C(CC2=C([O-])C(=O)/C2=C(\C#N)C(=O)OCC)C(C)(C)c2ccccc21,CC#N,460.0
CCOC(=O)Cc1csc(N=Nc2ccc(O)c3ncccc23)n1,CS(C)=O,565.0
CCOC(=O)[C@H](C)NC(=CC(=C1C(=O)N(C)c2ccccc21)c1ccccc1)c1ccccc1,ClCCl,442.0
CCOC(=O)c1[nH]c(C)c(/C=C/c2c(I)c(C)c3n2[B-](F)(F)[N+]2=C(C)C(I)=C(C)C2=C3c2cc(OC)cc(OC)c2)c1C,C1CCOC1,611.0
CCOC(=O)c1[nH]c(C)c(/C=C/c2c(I)c(C)c3n2[B-](F)(F)[N+]2=C(C)C(I)=C(C)C2=C3c2cc(OC)cc(OC)c2)c1C,CS(C)=O,612.0
CCOC(=O)c1[nH]c(C)c(/C=C/c2c(I)c(C)c3n2[B-](F)(F)[N+]2=C(C)C(I)=C(C)C2=C3c2cc(OC)cc(OC)c2)c1C,ClCCl,606.0
CCOC(=O)c1[nH]c(C)c(C(=O)CBr)c1C,O=C(O)C(F)(F)F,523.0
CCOC(=O)c1[nH]c(C)c(C(C)=O)c1C,O=C(O)C(F)(F)F,523.0
CCOC(=O)c1c(-c2c(Cl)c3cc(C)ccc3oc2=O)nn(-c2ccccc2)c1C(=O)OCC,ClCCl,332.0
CCOC(=O)c1c(-c2c(Cl)c3ccccc3oc2=O)nn(-c2ccc(Br)cc2)c1C(=O)OCC,ClCCl,322.0
CCOC(=O)c1c(-c2c(Cl)c3ccccc3oc2=O)nn(-c2ccc(OC)cc2)c1C(=O)OCC,ClCCl,321.0
CCOC(=O)c1c(-c2c(Cl)c3ccccc3oc2=O)nn(-c2cccc(C)c2)c1C(=O)OCC,ClCCl,321.0
CCOC(=O)c1c(-c2c(Cl)c3ccccc3oc2=O)nn(-c2cccc(Cl)c2)c1C(=O)OCC,ClCCl,321.0
CCOC(=O)c1c(-c2c(Cl)c3ccccc3oc2=O)nn(-c2ccccc2)c1C(=O)OCC,ClCCl,322.0
CCOC(=O)c1c(-c2cc3c(ccc4ccccc43)oc2=O)nn(-c2cccc(C)c2)c1C(=O)OCC,ClCCl,361.0
CCOC(=O)c1c(-c2cc3c(ccc4ccccc43)oc2=O)nn(-c2cccc(Cl)c2)c1C(=O)OCC,ClCCl,361.0
CCOC(=O)c1c(-c2cc3cc(OC)ccc3oc2=O)nn(-c2cccc(C)c2)c1C(=O)OCC,ClCCl,351.0
CCOC(=O)c1c(-c2cc3cc(OC)ccc3oc2=O)nn(-c2cccc(Cl)c2)c1C(=O)OCC,ClCCl,352.0
CCOC(=O)c1c(-c2cc3cc4c(cc3oc2=O)OC(C)(C)CC4)nn(-c2cccc(C)c2)c1C(=O)OCC,ClCCl,347.0
CCOC(=O)c1c(-c2cc3cc4c(cc3oc2=O)OC(C)(C)CC4)nn(-c2cccc(Cl)c2)c1C(=O)OCC,ClCCl,349.0
CCOC(=O)c1c(-c2cc3cc4c(cc3oc2=O)OC(C)(C)CC4)nn(-c2ccccc2)c1C(=O)OCC,ClCCl,348.0
CCOC(=O)c1c(-c2cc3ccc(OC)cc3oc2=O)nn(-c2cccc(C)c2)c1C(=O)OCC,ClCCl,337.0
CCOC(=O)c1c(-c2cc3ccc(OC)cc3oc2=O)nn(-c2cccc(Cl)c2)c1C(=O)OCC,ClCCl,337.0
CCOC(=O)c1c(-c2cc3ccc(OC)cc3oc2=O)nn(-c2ccccc2)c1C(=O)OCC,ClCCl,337.0
CCOC(=O)c1c(-c2cc3ccc(OCC=C(C)C)cc3oc2=O)nn(-c2cccc(C)c2)c1C(=O)OCC,ClCCl,338.0
CCOC(=O)c1c(-c2cc3ccc(OCC=C(C)C)cc3oc2=O)nn(-c2cccc(Cl)c2)c1C(=O)OCC,ClCCl,339.0
CCOC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2ccc(C)c(C)c2)c1C(=O)OCC,ClCCl,322.0
CCOC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2ccc(Cl)cc2)c1C(=O)OCC,ClCCl,323.0
CCOC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2ccc(OC)cc2)c1C(=O)OCC,ClCCl,323.0
CCOC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2cccc(C)c2)c1C(=O)OCC,ClCCl,321.0
CCOC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2cccc(Cl)c2)c1C(=O)OCC,ClCCl,325.0
CCOC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2cccc(F)c2)c1C(=O)OCC,ClCCl,324.0
CCOC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2ccccc2)c1C(=O)OCC,ClCCl,323.0
CCOC(=O)c1c(/N=C/c2ccc(-c3cccs3)s2)sc(/N=C/c2ccc(-c3cccs3)s2)c1C(=O)OCC,CC#N,492.0
CCOC(=O)c1c(/N=C/c2cccs2)sc(/N=C/c2ccc(-c3cccs3)s2)c1C(=O)OCC,CC#N,470.0
CCOC(=O)c1c(C(=O)OC)c(C(=O)OC)c2ccc(-c3ccc(Br)cc3)nn12,CC#N,350.0
CCOC(=O)c1c(C(=O)OC)c(C(=O)OC)c2ccc(-c3ccc(Cl)cc3)nn12,CC#N,350.0
CCOC(=O)c1c(C(=O)OCC)c2cccc(-c3ccccn3)n2c1C(=O)c1ccc(Br)cc1,CO,244.8
CCOC(=O)c1c(C)cn2c(nc3cc(C)c(C)cc32)c1-c1ccccc1,ClCCl,258.0
CCOC(=O)c1c(C)cn2c(nc3cc(C)c(C)cc32)c1C,ClCCl,251.0
CCOC(=O)c1c(C)cn2c(nc3ccccc32)c1-c1ccccc1,ClCCl,253.0
CCOC(=O)c1c(C)cn2c(nc3ccccc32)c1C,ClCCl,250.0
CCOC(=O)c1c(C=Cc2ccccc2)oc(NC2CCCCC2)c1C(=O)OCC,CC#N,384.0
CCOC(=O)c1c(CSc2ccccc2)n(C)c2cc(Br)c(O)c(CN(C)C)c12,O,275.0
CCOC(=O)c1c(N)sc(/N=C/c2ccc(-c3cccs3)s2)c1C(=O)OCC,CC#N,466.0
CCOC(=O)c1c(N)sc(/N=C/c2cccs2)c1C(=O)OCC,CC#N,400.0
CCOC(=O)c1c(N)sc(N=Nc2ccc(C)cc2)c1-c1ccccc1,CS(C)=O,469.0
CCOC(=O)c1c(N)sc(N=Nc2ccc(OC)cc2)c1-c1ccccc1,CS(C)=O,469.0
CCOC(=O)c1c(N)sc(N=Nc2ccc([N+](=O)[O-])cc2)c1-c1ccccc1,CO,529.0
CCOC(=O)c1c(N)sc(N=Nc2ccccc2)c1-c1ccccc1,CS(C)=O,468.0
CCOC(=O)c1c(N)sc2c1-c1ccccc1C2,CC(C)=O,330.0
CCOC(=O)c1c(N)sc2c1-c1ccccc1C2=Cc1ccc(N(C)C)cc1,CC(C)=O,421.0
CCOC(=O)c1c(N)sc2c1-c1ccccc1C2=Cc1ccc([N+](=O)[O-])cc1,CC(C)=O,492.0
CCOC(=O)c1c(NC(C)=O)sc2c1-c1ccccc1C2,CC(C)=O,332.0
CCOC(=O)c1c(O)c(N=Nc2ccc(C#N)cc2)c2ccccc2c1O,CS(C)=O,462.0
CCOC(=O)c1c(O)c(N=Nc2ccc(Cl)cc2)c2ccccc2c1O,CS(C)=O,468.0
CCOC(=O)c1c(O)c(N=Nc2ccc(OC)cc2)c2ccccc2c1O,CS(C)=O,485.0
CCOC(=O)c1c(O)c(N=Nc2ccc([N+](=O)[O-])cc2)c2ccccc2c1O,CS(C)=O,473.0
CCOC(=O)c1c(O)c(N=Nc2ccccc2)c2ccccc2c1O,CS(C)=O,460.0
CCOC(=O)c1c2c(c3n1CCCn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,CO,489.0
CCOC(=O)c1c2c(c3n1CCCn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,Cc1ccccc1,489.0
CCOC(=O)c1c2c(c3n1CCCn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,ClCCl,489.0
CCOC(=O)c1c2c(c3n1CCn1c(C(=O)OCC)c4c(c1-3)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-4c13)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-2c13,CO,435.0
CCOC(=O)c1c2c(c3n1CCn1c(C(=O)OCC)c4c(c1-3)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-4c13)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-2c13,Cc1ccccc1,435.0
CCOC(=O)c1c2c(c3n1CCn1c(C(=O)OCC)c4c(c1-3)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-4c13)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-2c13,ClCCl,435.0
CCOC(=O)c1c2c(c3n1CCn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,CO,512.0
CCOC(=O)c1c2c(c3n1CCn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,Cc1ccccc1,512.0
CCOC(=O)c1c2c(c3n1CCn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,ClCCl,512.0
CCOC(=O)c1c2c(c3n1Cn1c(C(=O)OCC)c4c(c1-3)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-4c13)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-2c13,CO,460.0
CCOC(=O)c1c2c(c3n1Cn1c(C(=O)OCC)c4c(c1-3)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-4c13)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-2c13,Cc1ccccc1,460.0
CCOC(=O)c1c2c(c3n1Cn1c(C(=O)OCC)c4c(c1-3)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-4c13)-c1ccc(C(=O)N(C)C)c3c(C(=O)N(C)C)ccc-2c13,ClCCl,460.0
CCOC(=O)c1c2c(c3n1Cn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,CO,527.0
CCOC(=O)c1c2c(c3n1Cn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,Cc1ccccc1,527.0
CCOC(=O)c1c2c(c3n1Cn1c(C(=O)OCC)c4c(c1-3)-c1ccc3c5c(ccc-4c15)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O)-c1ccc3c4c(ccc-2c14)C(=O)N(c1c(C(C)C)cccc1C(C)C)C3=O,ClCCl,527.0
CCOC(=O)c1c2c3c(ccc(Br)c3c3cc4c(cc13)[Si](C)(C)O[Si]4(C)C)N(C)C2=O,CC#N,382.0
CCOC(=O)c1c2c3c(ccc(Br)c3c3cc4ccccc4cc13)N(C)C2=O,CC#N,404.0
CCOC(=O)c1c2c3c(ccc(C)c3c3cc4c(cc13)[Si](C)(C)O[Si]4(C)C)N(C)C2=O,CC#N,380.0
CCOC(=O)c1c2c3c(ccc(C)c3c3cc4ccccc4cc13)N(C)C2=O,CC#N,404.0
CCOC(=O)c1c2c3c(ccc(Cl)c3c3cc4c(cc13)[Si](C)(C)O[Si]4(C)C)N(C)C2=O,CC#N,378.0
CCOC(=O)c1c2c3c(ccc(Cl)c3c3cc4ccccc4cc13)N(C)C2=O,CC#N,408.0
CCOC(=O)c1c2c3c(ccc(F)c3c3cc4c(cc13)[Si](C)(C)O[Si]4(C)C)N(C)C2=O,CC#N,380.0
CCOC(=O)c1c2c3c(ccc(F)c3c3cc4ccccc4cc13)N(C)C2=O,CC#N,410.0
CCOC(=O)c1c2c3c(ccc(OC)c3c3cc4c(cc13)[Si](C)(C)O[Si]4(C)C)N(C)C2=O,CC#N,378.0
CCOC(=O)c1c2c3c(ccc(OC)c3c3cc4ccccc4cc13)N(C)C2=O,CC#N,406.0
CCOC(=O)c1c2c3c(ccc([N+](=O)[O-])c3c3cc4c(cc13)[Si](C)(C)O[Si]4(C)C)N(C)C2=O,CC#N,376.0
CCOC(=O)c1c2c3c(ccc([N+](=O)[O-])c3c3cc4ccccc4cc13)N(C)C2=O,CC#N,394.0
CCOC(=O)c1c2c3c(cccc3c3cc4ccccc4cc13)N(C)C2=O,CC#N,398.0
CCOC(=O)c1c[nH]c2c([N+](=O)[O-])cc(F)cc2c1=O,CS(C)=O,268.0
CCOC(=O)c1c[nH]c2cc(-c3nc4ccccc4o3)c(O)cc2c1=O,ClC(Cl)Cl,597.0
CCOC(=O)c1c[nH]c2cc(-c3nc4ccccc4s3)c(O)cc2c1=O,C1COCCO1,638.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccc([N+](=O)[O-])cc1,C1COCCO1,421.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccc([N+](=O)[O-])cc1,CCCCCC,418.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccc([N+](=O)[O-])cc1,Cc1ccccc1,429.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccc([N+](=O)[O-])cc1,ClC(Cl)(Cl)Cl,426.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,C1CCOC1,408.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,C1COCCO1,405.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,CCCCCC,398.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,CCOC(C)=O,404.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,Cc1ccccc1,411.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,ClC(Cl)Cl,409.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,ClCCl,409.0
CCOC(=O)c1cc(C#Cc2ccc3cc(N4CCC4)ccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,O,408.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,C1CCOC1,367.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,C1COCCO1,365.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,CCCCCC,365.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,CO,364.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,CS(C)=O,368.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,Cc1ccccc1,370.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,ClC(Cl)Cl,370.0
CCOC(=O)c1cc(C#Cc2ccc3ccccc3c2)c(C(=O)OCC)cc1C#Cc1ccccc1,ClCCl,367.0
CCOC(=O)c1cc(C(=O)NCc2ccccc2)c2ccc(N(C)C)cc2n1,CCO,426.0
CCOC(=O)c1cc(C(=O)O)nc2cc(OC)ccc12,CCO,349.0
CCOC(=O)c1cc(C(=O)OC)c2c3ccccc3cnn12,C1CCCCC1,446.0
CCOC(=O)c1cc(C(=O)OC)c2ccc(-c3ccc(Br)cc3)nn12,CC#N,356.0
CCOC(=O)c1cc(C(=O)OC)c2ccc(-c3ccc(Cl)cc3)nn12,CC#N,357.0
CCOC(=O)c1cc(C(=O)OCC)c2cc(C(=O)O)ccc2n1,CCO,316.0
CCOC(=O)c1cc(C(=O)OCC)c2cc(C)ccc2n1,CCO,330.0
CCOC(=O)c1cc(C(=O)OCC)c2cc(N)ccc2n1,CCO,421.0
CCOC(=O)c1cc(C(=O)OCC)c2cc(NC(=O)C(F)(F)F)ccc2n1,CCO,346.0
CCOC(=O)c1cc(C(=O)OCC)c2cc(NC)ccc2n1,CCO,429.0
CCOC(=O)c1cc(C(=O)OCC)c2cc(O)ccc2n1,CCO,364.0
CCOC(=O)c1cc(C(=O)OCC)c2cc(OC)ccc2n1,CCO,355.0
CCOC(=O)c1cc(C(=O)OCC)c2cc([N+](=O)[O-])ccc2n1,CCO,304.0
CCOC(=O)c1cc(C(=O)OCC)c2ccc(C)cc2n1,CCO,321.0
CCOC(=O)c1cc(C(=O)OCC)c2ccc(N(C)C)cc2n1,CCO,430.0
CCOC(=O)c1cc(C(=O)OCC)c2ccc(O)cc2n1,CCO,373.0
CCOC(=O)c1cc(C(=O)OCC)c2ccc(OC)cc2n1,CCO,362.0
CCOC(=O)c1cc(C(=O)OCC)c2cccc(O)c2n1,CCO,369.0
CCOC(=O)c1cc(C(=O)OCC)c2cccc(OC)c2n1,CCO,368.0
CCOC(=O)c1cc(C(=O)OCC)c2cccc(OCc3ccccc3)c2n1,CCO,366.0
CCOC(=O)c1cc(C(=O)OCC)c2ccccc2n1,CCO,319.0
CCOC(=O)c1cc(C(=O)c2ccc(C)cc2)n2ncccc12,C1CCCCC1,437.0
CCOC(=O)c1cc(C(=O)c2ccc(Cl)cc2)n2ncccc12,CCO,436.0
CCOC(=O)c1cc(C(=O)c2ccc(F)cc2)n2ncccc12,CCO,442.0
CCOC(=O)c1cc(C(N)=O)n2ncccc12,CCO,437.0
CCOC(=O)c1cc(C)n2nc(-c3ccccc3)ccc12,C1CCCCC1,390.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,CCCCCC,410.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,CCO,401.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,CN(C)C=O,404.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,CO,398.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,CS(C)=O,405.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,Cc1ccccc1,412.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,ClCCl,406.0
CCOC(=O)c1cc(N2CCC2)c(C(=O)OCC)cc1N1CCC1,O,403.0
CCOC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3ccccc3[nH]2)n1,ClC(Cl)Cl,387.82
CCOC(=O)c1cc2c3ccccc3n(CC)c2c(-c2nc3ccccc3[nH]2)n1,ClC(Cl)Cl,382.14
CCOC(=O)c1cc2cc(C(=O)c3ccccc3)cn2cc1-c1ccc(Cl)cc1,ClCCl,279.0
CCOC(=O)c1cc2cc(C(=O)c3ccccc3)cn2cc1-c1cccs1,ClCCl,280.0
CCOC(=O)c1cc2cc(C(C)=O)cn2cc1-c1ccc(Cl)cc1,ClCCl,272.0
CCOC(=O)c1cc2cc(C(C)=O)cn2cc1-c1ccc(OC)cc1,ClCCl,266.0
CCOC(=O)c1cc2cc(C(C)=O)cn2cc1-c1ccccc1,ClCCl,269.0
CCOC(=O)c1cc2cc(C(C)=O)cn2cc1-c1cccs1,ClCCl,267.0
CCOC(=O)c1cc2cc3c4c(c2oc1=O)CCCN4CCC3,CCO,436.0
CCOC(=O)c1cc2cc3cc(OC)ccc3nc2[nH]c1=O,CC(C)=O,382.0
CCOC(=O)c1cc2cc3cc(OC)ccc3nc2nc1C,CC(C)=O,370.0
CCOC(=O)c1cc2cc3ccccc3nc2[nH]c1=O,CC(C)=O,377.0
CCOC(=O)c1cc2cc3ccccc3nc2nc1C,CC(C)=O,362.0
CCOC(=O)c1cc2ccc3ccccc3c2c(C(=O)OCC)c1N,Cc1ccccc1,427.0
CCOC(=O)c1ccc(-c2c(-c3ccc(C(=O)OCC)cc3)[n+]3c4ccccc4c(-c4ccc(C(=O)OCC)cc4)c(-c4ccc(C(=O)OCC)cc4)c3c3ccc(OC)cc23)cc1,ClCCl,442.0
CCOC(=O)c1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,CC#N,389.0
CCOC(=O)c1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,ClCCl,394.0
CCOC(=O)c1ccc(-c2c3cc(OC)ccc3nn2C)o1,CC#N,352.0
CCOC(=O)c1ccc(-c2c3cc(OC)ccc3nn2C)o1,ClCCl,356.0
CCOC(=O)c1ccc(-c2c3ccccc3nn2C)o1,CC#N,345.0
CCOC(=O)c1ccc(-c2c3ccccc3nn2C)o1,ClCCl,348.0
CCOC(=O)c1ccc(/C=C/C2=[N+]3C(=C(c4ccccc4)c4ccc(/C=C/c5ccc(C(=O)OCC)o5)n4[B-]3(F)F)C=C2)o1,ClC(Cl)Cl,671.0
CCOC(=O)c1ccc(C(=O)OCC)nc1,CC#N,513.0
CCOC(=O)c1ccc(C2=C(c3ccccc3)c3oc4ccccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,350.0
CCOC(=O)c1ccc(C2=C(c3ccccc3)c3sc4ccccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,374.0
CCOC(=O)c1ccc(C2=CC3=c4cc(-c5ccc(C(=O)OCC)cc5)c5nc(C(F)(F)C(F)(F)C(F)(F)F)nc6c(-c7ccc(C(=O)OCC)cc7)cc(c4c65)C4=CC(c5ccc(C(=O)OCC)cc5)=C5N=C(C(F)(F)C(F)(F)C(F)(F)F)N=C2C5C43)cc1,C1CCOC1,497.0
CCOC(=O)c1ccc(C2=Cc3ccccc3P2(=O)c2ccccc2)cc1,ClCCl,353.0
CCOC(=O)c1ccc(C2CC(c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)=NN2c2ccc(-c3nc4ccc(C)cc4s3)cc2)cc1,C1CCOC1,496.0
CCOC(=O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccc(C#N)cc2)cc1,ClCCl,376.0
CCOC(=O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccc(Cl)cc2)cc1,ClCCl,378.0
CCOC(=O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccc(F)cc2)cc1,ClCCl,375.0
CCOC(=O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccc(OC)cc2)cc1,ClCCl,383.0
CCOC(=O)c1ccc(N(C)C)cc1,CC#N,308.7912088
CCOC(=O)c1ccc(N(C)C)cc1,CCCCCC,298.6263736
CCOC(=O)c1ccc(N(C)C)cc1,CCO,309.0
CCOC(=O)c1ccc(N)cc1,CC#N,285.4368932
CCOC(=O)c1ccc(N)cc1,CCCCCC,269.6601942
CCOC(=O)c1ccc(N2CCC2)cc1,ClCCl,305.0
CCOC(=O)c1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,CC#N,391.0
CCOC(=O)c1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,CO,395.0
CCOC(=O)c1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,ClCCl,399.0
CCOC(=O)c1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,CO,482.0
CCOC(=O)c1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,CS(C)=O,487.0
CCOC(=O)c1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,Cc1ccccc1,486.0
CCOC(=O)c1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,ClCCl,481.0
CCOC(=O)c1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,O,491.0
CCOC(=O)c1ccc2c(c1)c1ccccc1c1nc3ccccc3n21,CC#N,352.0
CCOC(=O)c1ccc2nc(/N=N/c3ccc(N(CC)CC)cc3)sc2c1,CC#N,527.0
CCOC(=O)c1ccc2nc(/N=N/c3ccc(N(CC)CC)cc3)sc2c1,ClCCl,526.0
CCOC(=O)c1ccc2nc(N)sc2c1,CC#N,293.0
CCOC(=O)c1ccc2nc(N)sc2c1,ClCCl,293.0
CCOC(=O)c1cccc(N(C)C)c1,CC#N,340.9340659
CCOC(=O)c1cccc(N(C)C)c1,CCCCCC,334.6153846
CCOC(=O)c1cccc(N)c1,CC#N,322.5728155
CCOC(=O)c1cccc(N)c1,CCCCCC,315.0485437
CCOC(=O)c1cccc2ccccc12,CCOC(C)=O,443.0
CCOC(=O)c1ccccc1-c1c2cc(Br)c(=O)c(Br)c-2oc2c(Br)c(O)c(Br)cc12,O,522.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C)ccc12,C1CCOC1,428.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C)ccc12,CC#N,445.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C)ccc12,CCO,433.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CO[Si](C)(C)C(C)(C)C)NC(=O)OC(C)(C)C)ccc12,CS(C)=O,449.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CSCc3ccc(C)cc3)NC(=O)OC(C)(C)C)ccc12,C1CCOC1,431.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CSCc3ccc(C)cc3)NC(=O)OC(C)(C)C)ccc12,CC#N,431.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CSCc3ccc(C)cc3)NC(=O)OC(C)(C)C)ccc12,CCO,435.0
CCOC(=O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(OC(=O)[C@H](CSCc3ccc(C)cc3)NC(=O)OC(C)(C)C)ccc12,CS(C)=O,457.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1c3c4c(cc12)CCCN4CCC3,CCO,616.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1c3c4c(cc12)CCCN4CCC3,ClC(Cl)Cl,625.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1c3c4c(cc12)CCCN4CCC3,O,616.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1cc(N(CC)CC)ccc12,CCO,595.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1cc(N(CC)CC)ccc12,ClC(Cl)Cl,601.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1cc(N(CC)CC)ccc12,O,596.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1cc3c(cc12)CCCN3C,CCO,602.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1cc3c(cc12)CCCN3C,ClC(Cl)Cl,608.0
CCOC(=O)c1ccccc1-c1c2ccc(=[N+](CC)CC)cc-2oc2c1c(=O)oc1cc3c(cc12)CCCN3C,O,602.0
CCOC(=O)c1ccn2c(c1)nc1ccccc12,ClCCl,248.0
CCOC(=O)c1ccn2c(nc3cc(C)c(C)cc32)c1-c1ccccc1,ClCCl,228.0
CCOC(=O)c1ccn2c(nc3cc(C)c(C)cc32)c1C,ClCCl,252.0
CCOC(=O)c1ccn2c(nc3ccccc32)c1-c1ccccc1,ClCCl,256.0
CCOC(=O)c1ccn2c(nc3ccccc32)c1C,ClCCl,250.0
CCOC(=O)c1ccn2nc(-c3ccc(OC)c(OC)c3)cc2c1,C1CCCCC1,297.0
CCOC(=O)c1ccn2nc(-c3ccc4ccccc4c3)cc2c1,C1CCCCC1,298.0
CCOC(=O)c1csc2[n+]1[B-](F)(F)OC(c1ccc(N(C)C)cc1)=N2,C1CCOC1,404.0
CCOC(=O)c1csc2[n+]1[B-](F)(F)OC(c1ccc(N(C)C)cc1)=N2,CC#N,405.0
CCOC(=O)c1csc2[n+]1[B-](F)(F)OC(c1ccc(N(C)C)cc1)=N2,Cc1ccccc1,406.0
CCOC(=O)c1csc2[n+]1[B-](F)(F)OC(c1ccc(N(C)C)cc1)=N2,ClCCl,412.0
CCOC(=O)c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1,C1CCOC1,277.0
CCOC(=O)c1sc(-c2ccc(-c3cc(C4CC4)c(C(=O)OCC)s3)s2)cc1C1CC1,ClCCl,395.0
CCOC(=O)c1sc(SC)c2c(=O)[nH]nnc12,C1CCOC1,380.5
CCOC(=O)c1sc(SC)c2c(=O)[nH]nnc12,CC#N,381.0
CCOC(=O)c1sc(SC)c2c(=O)[nH]nnc12,CCO,385.0
CCOC(=O)c1sc(SC)c2c(=O)[nH]nnc12,CN(C)C=O,389.0
CCOC(=O)c1sc(SC)c2c(=O)[nH]nnc12,CO,384.5
CCOC(=O)c1sc(SC)c2c(=O)[nH]nnc12,CS(C)=O,387.5
CCOC(=O)c1sc(SC)c2c(=O)n(C)nnc12,C1CCOC1,387.5
CCOC(=O)c1sc(SC)c2c(=O)n(C)nnc12,CC#N,388.0
CCOC(=O)c1sc(SC)c2c(=O)n(C)nnc12,CCO,391.0
CCOC(=O)c1sc(SC)c2c(=O)n(C)nnc12,CN(C)C=O,391.5
CCOC(=O)c1sc(SC)c2c(=O)n(C)nnc12,CO,391.5
CCOC(=O)c1sc(SC)c2c(=O)n(C)nnc12,CS(C)=O,393.5
CCOC(=O)c1sc2nc(-c3ccc(OC)cc3)c(C)c(C#N)c2c1N,c1ccccc1,417.0
CCOC(=O)c1sc2nc(-c3ccco3)cc(C(F)(F)F)c2c1N=Nc1ccc(N(C)C)cc1,CN(C)C=O,448.0
CCOC(=O)c1sc2nc(C)c(C)c(C#N)c2c1N,c1ccccc1,406.0
CCOC(=O)c1sc2nc(C)c(CC)c(C#N)c2c1N,c1ccccc1,412.0
CCOC(=O)c1sc2nc3c(c(C#N)c2c1N)CCCC3,c1ccccc1,420.0
CCOC(=O)c1sc2nc3c(c(C#N)c2c1N)CCCCCC3,c1ccccc1,410.0
CCOC(CN1C(=O)C2=C(c3cc4cc(C(C)(C)C)cc(C(C)(C)C)c4o3)N(CC(OCC)OCC)C(=O)C2=C1c1cc2cc(C(C)(C)C)cc(C(C)(C)C)c2o1)OCC,ClC(Cl)Cl,580.0
CCOC(CN1C(=O)C2=C(c3cccs3)N(CC(OCC)OCC)C(=O)C2=C1c1cccs1)OCC,ClC(Cl)Cl,533.0
CCOC(CN1C(=O)C2=C(c3ccsc3)N(CC(OCC)OCC)C(=O)C2=C1c1ccsc1)OCC,ClC(Cl)Cl,493.0
CCOC(O)C(=O)c1ccccc1,CCO,413.0
CCOC(OCC)c1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,563.0
CCOC1=C([O-])C(/C=C2/N(CCC(=O)O)c3ccc(C(=O)O)cc3C2(C)C)C1=O,CCO,425.0
CCOC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(N(C)C)cc2)=C1C#N,C1CCOC1,411.0
CCOC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(N(C)C)cc2)=C1C#N,CS(C)=O,427.0
CCOC1CC(C(=O)OC)=C2C=CC=NN21,C1CCCCC1,496.0
CCOC1CCN2c3c1cc(-c1cc(C)c(-c4sc(/C=C(\C#N)C(=O)O)cc4C)s1)cc3C(OCC)CC2C(C)C,CCO,422.0
CCOC1CCN2c3c1cc(-c1ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s1)cc3C(OCC)CC2C(C)C,CCO,462.0
CCOC1CCN2c3c1cc(-c1sc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)c4c1OCCO4)cc3C(OCC)CC2C(C)C,CCO,506.0
CCOCC,CO,458.0
CCOCCC1=Cc2nc1ccc1[nH]c(cc1CCOCC)c1nc(ccc3[nH]c2cc3CCOCC)C(CCOCC)=C1,Cc1ccccc1,638.0
CCOCCCn1c(Nc2ccc([N+](=O)[O-])cc2)nc2cc3c(C)c(C(N)=O)c(=O)oc3cc21,CCO,382.0
CCOCCOCCOC(=O)/C=C/C1=CC2=C(c3c(C)cc(C)cc3C)c3cc(/C=C/C(=O)OCCOCCOCC)cn3[B-](F)(F)[N+]2=C1,ClCCl,577.0
CCOCCOCCOC(=O)/C=C/C1=CC2=C(c3c(C)cc(C)cc3C)c3cccn3[B-](F)(F)[N+]2=C1,ClCCl,536.0
CCOP1(=O)C2=CC(=[N+](C)C)C=CC2=C(c2ccccc2C)c2ccc(N(C)C)cc21,O,698.0
CCOP1(=O)c2c(cc3c4c2CCCN4CCC3)C(c2ccccc2C)=c2cc3c4c(c21)CCC[N+]=4CCC3,O,744.0
CCO[B-]1(OCC)n2c(C)cc(C)c2C(c2ccc(I)cc2)=C2C(C)=CC(C)=[N+]21,ClC(Cl)Cl,505.0
CCO[Si](OCC)(OCC)c1ccc(-c2ccc(-c3cc4ccc(N(c5ccc6c(c5)C(C)(C)c5ccccc5-6)c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4s3)s2)s1,C1CCOC1,419.0
CCO[Si](OCC)(OCC)c1ccc(N=Nc2ccc(N(C)C)cc2)cc1,CCO,416.0
CCO[Si](OCC)(OCC)c1ccc2oc(-c3cc4ccc(N(CC)CC)cc4oc3=O)nc2c1,CC#N,440.0
CCO[Si](OCC)(OCC)c1ccc2oc(-c3cc4ccc(N(CC)CC)cc4oc3=O)nc2c1,Cc1ccccc1,420.0
CCO[Si](OCC)(c1ccccc1)c1ccc(N=Nc2ccc(N(C)C)cc2)cc1,CC#N,423.0
CCO[Si](OCC)(c1ccccc1)c1ccc(N=Nc2ccccc2)cc1,CC#N,444.0
CCOc1c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cccc1OC,CS(C)=O,557.0
CCOc1c(C(=O)OC)c(C(=O)OC)c2cccnn12,C1CCCCC1,431.0
CCOc1c(F)c(F)c(C2=C(C)C(=O)n3c2cc2c(C)cc(C)n2c3=O)c(F)c1F,C1CCCCC1,448.0
CCOc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)ccc1OC,CS(C)=O,568.0
CCOc1cc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(OCC)cc1/C=C(/C#N)C(=O)O,ClCCl,478.0
CCOc1cc(C(=O)OC)c2cccnn12,C1CCCCC1,429.0
CCOc1cc(C=C2c3ccccc3-c3ccccc32)c(OCC)cc1C=C1c2ccccc2C=Cc2ccccc21,C1CCOC1,395.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,C1CCOC1,476.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,CC#N,474.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,CCO,480.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,CCOC(C)=O,469.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,CN(C)C=O,487.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,CS(C)=O,491.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,Cc1ccccc1,474.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,ClC(Cl)Cl,480.0
CCOc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2CC,ClCCl,479.0
CCOc1ccc(-[n+]2nc3c(-c4ccccc4)cc(OCC)cc3c3ccccc32)cc1,ClCCl,443.0
CCOc1ccc(-c2ccc(N=Nc3ncc(C)s3)s2)s1,C1COCCO1,535.0
CCOc1ccc(-c2ccc(N=Nc3nccs3)s2)s1,C1COCCO1,531.0
CCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CC#N,412.0
CCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CC1CCCCC1,414.0
CCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,Cc1ccccc1,419.0
CCOc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,ClCCl,420.0
CCOc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(OCC)c1,CS(C)=O,572.0
CCOc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1OC,CS(C)=O,568.0
CCOc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1OCC,CS(C)=O,568.0
CCOc1ccc(N(c2ccc(C=Cc3ccnc(-n4ccnc4)n3)cc2)c2ccc(OCC)cc2)cc1,CN(C)C=O,424.0
CCOc1ccc(N(c2ccc(OCC)cc2)c2ccc(-c3ccc(-c4ccc5c(c4)sc4c[n+](CCCS(=O)(=O)[O-])ccc45)s3)cc2)cc1,CS(C)=O,465.0
CCOc1ccc(N(c2ccc(OCC)cc2)c2ccc(-c3ccc(-c4ccc5c(c4)sc4cnccc45)s3)cc2)cc1,CS(C)=O,412.0
CCOc1ccc(N(c2ccc(OCC)cc2)c2ccc(C(n3cccn3)n3cccn3)cc2)cc1,CN(C)C=O,300.0
CCOc1ccc2c(-c3nc(-c4cccc(Br)c4)no3)cc(=O)oc2c1,CCO,388.0
CCOc1ccc2c(-c3nc(-c4cccc(Br)c4)no3)cc(=O)oc2c1,ClC(Cl)Cl,403.0
CCOc1ccc2c(-c3nc(-c4cccc(C)c4)no3)cc(=O)oc2c1,CCO,345.0
CCOc1ccc2c(-c3nc(-c4cccc(C)c4)no3)cc(=O)oc2c1,ClC(Cl)Cl,322.0
CCOc1ccc2c(-c3nc(-c4ccccc4)no3)cc(=O)oc2c1,CCO,388.0
CCOc1ccc2c(-c3nc(-c4ccccc4)no3)cc(=O)oc2c1,ClC(Cl)Cl,392.0
CCOc1ccc2c(-c3nc(-c4ccccc4F)no3)cc(=O)oc2c1,CCO,345.0
CCOc1ccc2c(-c3nc(-c4ccccc4F)no3)cc(=O)oc2c1,ClC(Cl)Cl,393.0
CCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,C1CCOC1,342.0
CCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CCCCCC,338.0
CCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CCO,344.0
CCOc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CS(C)=O,345.0
CCOc1cccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)c1O,ClCCl,335.0
CCOc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1,CS(C)=O,555.0
CCOc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1O,CS(C)=O,562.0
CCOc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1OCC,CS(C)=O,557.0
CCOc1cccc2c1O[B-](F)(F)[n+]1c3c(c4c(c1-2)-c1ccccc1CC4)-c1ccccc1CC3,ClCCl,343.0
CCOc1ccccc1-c1c(C#N)c(N)nc(N)c1C#N,C1CCOC1,338.0
CCOc1ccccc1-c1ccc(=O)n(-c2ccc(N(C)C)cc2)n1,CS(C)=O,375.0
CCOc1nc(-c2ccc(C)cc2)cc(-c2ccc(N3CCOCC3)cc2)c1C#N,ClC(Cl)Cl,332.5
CCOc1nc(-c2ccc(Cl)cc2)cc(-c2ccc(N3CCOCC3)cc2)c1C#N,ClC(Cl)Cl,330.0
CCOc1nc(-c2ccc(F)cc2)cc(-c2ccc(N3CCOCC3)cc2)c1C#N,ClC(Cl)Cl,329.0
CCOc1nc(-c2ccc(OC)cc2)cc(-c2ccc(N3CCOCC3)cc2)c1C#N,ClC(Cl)Cl,311.0
CCOc1nc(-c2cccs2)cc(-c2ccc(N3CCOCC3)cc2)c1C#N,ClC(Cl)Cl,331.0
CCOc1nc2c(c(-c3ccc(N4CCOCC4)cc3)c1C#N)CSc1ccccc1-2,ClC(Cl)Cl,240.0
CCOc1nc2c(c(-c3ccc(N4CCOCC4)cc3)c1C#N)Cc1ccccc1-2,ClC(Cl)Cl,331.0
CCSSCC,CCCCCC,250.0
CCSc1c2ccc(=[N+](CC)CC)cc-2oc2cc(N(CC)CC)ccc12,O,593.0
CC[B-]1(CC)c2cccc3c4c5c(cccc5c(c23)-c2cccc(C)[n+]21)[B-](CC)(CC)[n+]1c(C)cccc1-4,ClCCl,538.0
CC[C@H](C)COc1ccc(C2=C3C(C)=C(c4ccc5ccc6cccc7ccc4c5c67)C(C)=[N+]3[B-](F)(F)n3c(C)c(-c4ccc5ccc6cccc7ccc4c5c67)c(C)c32)cc1,ClCCl,530.0
CC[C@H](C)COc1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,ClCCl,501.0
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,CN(C)C=O,498.0
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)[C@@H](C)CC,CN(C)C=O,502.0
CC[C@H](C)[C@H](Nc1c(C(C)=O)c(=O)oc2cc(N(C)C)ccc12)C(=O)O,ClCCl,371.0
CC[N+](CC)=C1C=CC(=C/C=C2\C=C(c3ccccc3C(=O)O)c3cc4c5c(c3O2)CCCN5CCC4)C=C1,O,678.0
CC[N+](CC)=C1C=CC(=C2C=C(c3ccccc3C(=O)O)c3cc4c5c(c3O2)CCCN5CCC4)C=C1,O,612.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3c(=O)oc4c5c6c(cc4c3oc-2c1)CCCN6CCC5,CCO,612.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3c(=O)oc4c5c6c(cc4c3oc-2c1)CCCN6CCC5,ClC(Cl)Cl,623.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3c(=O)oc4c5c6c(cc4c3oc-2c1)CCCN6CCC5,O,612.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3c(=O)oc4cc(N(c5ccccc5)c5ccccc5)ccc4c3oc-2c1,ClC(Cl)Cl,610.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3c(=O)oc4ccccc4c3oc-2c1,CCO,598.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3cc4c(-c5ccccc5C(=O)O)c5ccc(=[N+](CC)CC)cc-5oc4cc3oc-2c1,ClC(Cl)Cl,598.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3ccc4cc(O)ccc4c3oc-2c1,O,550.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3oc4cc(N)ccc4c3oc-2c1,CCO,572.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3oc4cc(N)ccc4c3oc-2c1,ClCCl,581.0
CC[N+](CC)=c1ccc2c(-c3ccccc3C(=O)O)c3oc4cc(N)ccc4c3oc-2c1,O,581.0
CC[N+](CC)=c1ccc2c(C(F)(F)F)c3c(oc-2c1)-c1ccc(N(C)C)cc1CC3,CCO,680.0
CC[N+](CC)=c1ccc2c(C(F)(F)F)c3c(oc-2c1)-c1ccc(N(C)C)cc1CC3,ClCCl,684.0
CC[N+](CC)=c1ccc2c(C(F)(F)F)c3c(oc-2c1)-c1ccc(N(C)C)cc1CC3,O,672.0
CC[N+](CC)=c1ccc2c(C(F)(F)F)c3oc4cc(N)ccc4c3oc-2c1,CCO,640.0
CC[N+](CC)=c1ccc2c(C(F)(F)F)c3oc4cc(N)ccc4c3oc-2c1,ClCCl,658.0
CC[N+](CC)=c1ccc2c(C(F)(F)F)c3oc4cc(N)ccc4c3oc-2c1,O,640.0
CC[N+](CC)=c1ccc2cc3c(=O)oc4cc5c(cc4c3oc-2c1)CCCN5C,ClCCl,618.0
CC[N+](CC)=c1ccc2cc3c(=O)oc4cc5c(cc4c3oc-2c1)CCCN5C,O,598.0
CC[N+](CC)=c1ccc2cc3c(oc-2c1)-c1ccc(N(C)C)cc1CC3,CCO,612.0
CC[N+](CC)=c1ccc2cc3c(oc-2c1)-c1ccc(N(C)C)cc1CC3,ClCCl,619.0
CC[N+](CC)=c1ccc2cc3c(oc-2c1)-c1ccc(N(C)C)cc1CC3,O,604.0
CC[N+](CC)=c1ccc2nc3c(cc(NCCC(=O)NC(C)C(=O)OC)c4ccccc43)oc-2c1,CCO,600.0
CC[N+](CC)=c1ccc2nc3c(cc(NCCC(=O)NC(C)C(=O)OC)c4ccccc43)oc-2c1,O,580.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1c(OC)ccc(OC)c12,O,368.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1cc(C)ccc12,O,379.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1cc(F)ccc12,O,375.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1cc(OC)c(OC)cc12,O,392.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1cc(OC)ccc12,O,394.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1cc(Oc3ccccc3)ccc12,O,387.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1cc(SC)ccc12,O,397.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1ccc(C)cc12,O,370.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1ccc(Cl)cc12,O,367.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1ccc(OC)cc12,O,372.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1ccccc12,CN(C)C=O,361.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)O)=Cc1ccccc12,O,373.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)[O-])=Cc1ccccc12,CN(C)C=O,378.0
CC[N+]1(CC)CN2C(=N1)C(C(=O)[O-])=Cc1ccccc12,O,369.0
CC[N+]1(CC)CN2C(C)=CC(C)=C(C(=O)O)C2=N1,CN(C)C=O,346.0
CC[N+]1(CC)CN2C(C)=CC(C)=C(C(=O)O)C2=N1,O,343.0
CC[N+]1(CC)CN2C(C)=CC(C)=C(C(=O)[O-])C2=N1,CN(C)C=O,361.0
CC[N+]1(CC)CN2C(C)=CC(C)=C(C(=O)[O-])C2=N1,O,338.0
CC[N+]1=C(/C=C/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccccc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,CO,751.0
CC[N+]1=C(/C=C/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccccc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,745.0
CC[N+]1=C(/C=C/c2c(C)nn3c(-c4ccc(OC)cc4)ccnc23)C(C)(C)c2ccccc21,CCO,478.0
CC[N+]1=C(/C=C/c2c(C)nn3c(-c4ccc(OC)cc4)ccnc23)C(C)(C)c2ccccc21,ClCCl,484.0
CC[N+]1=C(/C=C/c2c(C)nn3c(-c4ccc(OC)cc4)ccnc23)C(C)(C)c2ccccc21,O,464.0
CC[N+]1=C(/C=C/c2cc3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc2c5c43)C(C)(C)c2ccccc21,C1CCOC1,514.0
CC[N+]1=C(/C=C/c2cc3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc2c5c43)C(C)(C)c2ccccc21,CC#N,492.0
CC[N+]1=C(/C=C/c2cc3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc2c5c43)C(C)(C)c2ccccc21,CS(C)=O,489.0
CC[N+]1=C(/C=C/c2cc3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc2c5c43)C(C)(C)c2ccccc21,Cc1ccccc1,548.0
CC[N+]1=C(/C=C/c2cc3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc2c5c43)C(C)(C)c2ccccc21,O,541.0
CC[N+]1=C(/C=C/c2cc3cc(C(C)(C)C)cc4ccc5cc(C(C)(C)C)cc2c5c43)C(C)(C)c2ccccc21,OCC(O)CO,510.0
CC[N+]1=C(/C=C/c2cc3ccc4cccc5ccc(c2)c3c45)C(C)(C)c2ccccc21,C1CCOC1,418.0
CC[N+]1=C(/C=C/c2cc3ccc4cccc5ccc(c2)c3c45)C(C)(C)c2ccccc21,CC#N,410.0
CC[N+]1=C(/C=C/c2cc3ccc4cccc5ccc(c2)c3c45)C(C)(C)c2ccccc21,CS(C)=O,412.0
CC[N+]1=C(/C=C/c2cc3ccc4cccc5ccc(c2)c3c45)C(C)(C)c2ccccc21,Cc1ccccc1,434.0
CC[N+]1=C(/C=C/c2cc3ccc4cccc5ccc(c2)c3c45)C(C)(C)c2ccccc21,O,408.0
CC[N+]1=C(/C=C/c2cc3cccc4ccc5cccc2c5c43)C(C)(C)c2ccccc21,C1CCOC1,504.0
CC[N+]1=C(/C=C/c2cc3cccc4ccc5cccc2c5c43)C(C)(C)c2ccccc21,CC#N,482.0
CC[N+]1=C(/C=C/c2cc3cccc4ccc5cccc2c5c43)C(C)(C)c2ccccc21,CS(C)=O,478.0
CC[N+]1=C(/C=C/c2cc3cccc4ccc5cccc2c5c43)C(C)(C)c2ccccc21,Cc1ccccc1,521.0
CC[N+]1=C(/C=C/c2cc3cccc4ccc5cccc2c5c43)C(C)(C)c2ccccc21,O,476.0
CC[N+]1=C(/C=C/c2cc3cccc4ccc5cccc2c5c43)C(C)(C)c2ccccc21,OCC(O)CO,494.0
CC[N+]1=C(/C=C2/C(=O)C(c3ccc(-n4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc54)s3)=C2[O-])Cc2cc(C(=O)O)ccc21,ClCCl,637.0
CC[N+]1=C(/C=C2/C(=O)C(c3ccc(-n4c5ccccc5c5ccccc54)s3)=C2[O-])Cc2cc(C(=O)O)ccc21,ClCCl,605.0
CC[N+]1=C(C=CC=C2N(CCCCCC(=O)ON3C(=O)CCC3=O)c3ccc4c(S(=O)(=O)O)cc(S(=O)(=O)O)cc4c3C2(C)C)C(C)(C)c2c1ccc1c(S(=O)(=O)O)cc(S(=O)(=O)[O-])cc21,O,576.0
CC[N+]1=C(C=CC=CC=C2N(CCCCCC(=O)ON3C(=O)CCC3=O)c3ccc(S(=O)(=O)O)cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,647.0
CC[N+]1=C(C=CC=CC=CC=C2N(CCCCCC(=O)ON3C(=O)CCC3=O)c3ccc(S(=O)(=O)O)cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,753.0
CC[N+]1=C(C=Cc2cnc(N=Nc3cc4c5c(c3)CCCN5CCC4)s2)C(C)(C)c2ccccc21,CO,810.0
CC[N+]1=c2cc3c(cc2C(C)=CC1(C)C)=Cc1ccc(N(C)C)cc1C3(C)C,CCO,634.0
CC[N+]1=c2cc3c(cc2C(C)=CC1(C)C)=Nc1cc2c(cc1O3)N(CCCC(=O)O)CCC2,O,664.0
CC[N+]1=c2cc3c(cc2CC1)=Cc1ccc(N(C)C)cc1C3(C)C,CCO,617.0
CC[N+]1=c2cc3c(cc2CC1)=Nc1ccc(N)cc1O3,CCO,612.0
CC[N+]1=c2cc3c(cc2CCC1)=Cc1ccc(N(C)C)cc1C3(C)C,CCO,616.0
CC[N+]1=c2cc3c(cc2CCC1)=Nc1cc2c(cc1O3)N(CCCC(=O)O)CCC2,O,662.0
CC[NH+](CC)c1ccc(-c2nc3c(nc2-c2ccc(B(c4c(C)cc(C)cc4C)c4c(C)cc(C)cc4C)cc2)c2ccccc2n3C)cc1,C1CCOC1,385.5555556
CC[PH](CC)(CC)[Pt](C#Cc1cc(C#Cc2ccc(N(C)C)cc2)cc(C#Cc2ccc3c(c2)C(C)(C)c2ccccc2-3)c1)(C#Cc1ccc(/C=C(/C#N)C(=O)O)s1)[PH](CC)(CC)CC,ClCCl,460.0
CC[PH](CC)(CC)[Pt](C#Cc1cc(C#Cc2ccc(N(C)C)cc2)cc(C#Cc2ccc3c(c2)C(C)(C)c2ccccc2-3)c1)(C#Cc1ccc(C#C/C=C(/C#N)C(=O)O)s1)[PH](CC)(CC)CC,ClCCl,389.0
CC[PH](CC)(CC)[Pt](C#Cc1cc(C#Cc2ccc(N(C)C)cc2)cc(C#Cc2ccc3c(c2)C(C)(C)c2ccccc2-3)c1)(C#Cc1sc(/C=C(/C#N)C(=O)O)c2c1OCCO2)[PH](CC)(CC)CC,ClCCl,483.0
CC[PH](CC)(CC)[Pt](C#Cc1ccc(C=C(C#N)C(=O)O)cc1)(C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)[PH](CC)(CC)CC,C1CCOC1,357.0
CC[PH](CC)(CC)[Pt](C#Cc1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)(C#Cc1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)s1)[PH](CC)(CC)CC,ClCCl,508.0
CC[PH](CC)(CC)[Pt](C#Cc1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)(C#Cc1ccc(/C=C(/C#N)C(=O)O)s1)[PH](CC)(CC)CC,ClCCl,461.0
CC[PH](CC)(CC)[Pt](C#Cc1ccc(N(c2ccc3c(c2)C(C)(C)c2ccccc2-3)c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1)(C#Cc1ccc(C=C(C#N)C(=O)O)s1)[PH](CC)(CC)CC,ClCCl,461.0
CC[PH](CC)(CC)[Pt](C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)(C#Cc1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)s1)[PH](CC)(CC)CC,ClCCl,510.0
CC[PH](CC)(CC)[Pt](C#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)(C#Cc1ccc(/C=C/c2ccc(/C=C(/C#N)C(=O)O)s2)s1)[PH](CC)(CC)CC,ClCCl,528.0
CC[Si](C)(C)c1cc2ccc3cccc4ccc(c1C(=O)NC(C)(C)C)c2c34,ClC(Cl)Cl,381.0
CC[Si](CC)(CC)c1cc2ccc3cccc4ccc(c1C(=O)NC(C)(C)C)c2c34,ClC(Cl)Cl,381.0
CC[n+]1c(-c2ccccc2)c2cc(-n3cccc3)ccc2c2ccc(-n3cccc3)cc21,O,429.0
CC[n+]1c(-c2ccccc2)c2cc(-n3cccc3)ccc2c2ccc(N)cc21,O,462.0
CC[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(-n3cccc3)cc21,O,454.0
CC[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(N)cc21,O,480.0
CC[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(NC(N)=O)cc21,O,458.0
CC[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(NC(N)=[NH2+])cc21,O,444.0
CC[n+]1c(-c2ccccc2)c2cc(NC(=O)NCC[NH3+])ccc2c2ccc(NC(=O)NCC[NH3+])cc21,O,438.0
CC[n+]1c(-c2ccccc2)c2cc(NC(=O)N[C@H]3C[C@@H]([NH3+])[C@H](O)[C@@H](O)[C@@H]3O)ccc2c2ccc(NC(=O)N[C@@H]3C[C@H]([NH3+])[C@@H](O)[C@@H](O)[C@H]3O)cc21,O,438.0
CC[n+]1c(-c2ccccc2)c2cc(NC(N)=O)ccc2c2ccc(N)cc21,O,463.0
CC[n+]1c(-c2ccccc2)c2cc(NC(N)=O)ccc2c2ccc(NC(N)=O)cc21,O,434.0
CC[n+]1c(-c2ccccc2)c2cc(NC(N)=[NH2+])ccc2c2ccc(N)cc21,O,454.0
CC[n+]1c(-c2ccccc2)c2cc(NC(N)=[NH2+])ccc2c2ccc(NC(N)=[NH2+])cc21,O,397.0
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,C1CCOC1,607.1403738
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,CC#N,579.1525424
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,CC(C)=O,590.5606258
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,CO,519.0699696
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,CS(C)=O,581.2820513
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,Cc1ccccc1,623.5680139
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,ClC(Cl)Cl,593.906997
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,ClCCl,597.5575837
CC[n+]1c(/C=C/c2c([O-])ccc3ccc(=O)oc23)sc2ccccc21,O,492.7553238
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccc(Cl)cc4C3(C)C)=C2[O-])sc2ccccc21,CO,634.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccc(Cl)cc4C3(C)C)=C2[O-])sc2ccccc21,ClC(Cl)Cl,649.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccc(Cl)cc4C3(C)C)=C2[O-])sc2ccccc21,ClCCl,650.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccccc4C3(C)C)=C2[O-])[se]c2ccccc21,CO,643.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccccc4C3(C)C)=C2[O-])[se]c2ccccc21,ClC(Cl)Cl,657.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccccc4C3(C)C)=C2[O-])[se]c2ccccc21,ClCCl,658.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccccc4C3(C)C)=C2[O-])sc2ccccc21,CO,635.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccccc4C3(C)C)=C2[O-])sc2ccccc21,ClC(Cl)Cl,649.0
CC[n+]1c(C=C2C(=O)C(C=C3N(C)c4ccccc4C3(C)C)=C2[O-])sc2ccccc21,ClCCl,650.0
CC[n+]1c(C=C2C(=O)C(C=C3Sc4cc(Cl)ccc4N3C)=C2[O-])[se]c2ccccc21,CO,658.0
CC[n+]1c(C=C2C(=O)C(C=C3Sc4cc(Cl)ccc4N3C)=C2[O-])[se]c2ccccc21,ClC(Cl)Cl,677.0
CC[n+]1c(C=C2C(=O)C(C=C3Sc4cc(Cl)ccc4N3C)=C2[O-])[se]c2ccccc21,ClCCl,678.0
CC[n+]1ccc(/C=C/c2cc3cccc4ccc5cccc2c5c43)cc1,C1CCOC1,424.0
CC[n+]1ccc(/C=C/c2cc3cccc4ccc5cccc2c5c43)cc1,CC#N,420.0
CC[n+]1ccc(/C=C/c2cc3cccc4ccc5cccc2c5c43)cc1,CS(C)=O,420.0
CC[n+]1ccc(/C=C/c2cc3cccc4ccc5cccc2c5c43)cc1,Cc1ccccc1,428.0
CC[n+]1ccc(/C=C/c2cc3cccc4ccc5cccc2c5c43)cc1,O,411.0
CC[n+]1ccc(/C=C/c2cc3cccc4ccc5cccc2c5c43)cc1,OCC(O)CO,425.0
CC[n+]1ccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,C1CCOC1,447.0
CC[n+]1ccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CC#N,438.0
CC[n+]1ccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CS(C)=O,440.0
CC[n+]1ccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,Cc1ccccc1,454.0
CC[n+]1ccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,O,428.0
CC[n+]1ccc(/C=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,OCC(O)CO,440.0
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,C1CCOC1,629.8635744
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,CC#N,591.0277399
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,CC(C)=O,603.4424739
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,CO,535.6389268
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,CS(C)=O,593.4151887
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,Cc1ccccc1,655.0113688
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,ClC(Cl)Cl,614.5839018
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,ClCCl,614.5839018
CC[n+]1ccc2ccccc2c1/C=C/c1c([O-])ccc2ccc(=O)oc12,O,491.7098681
CC[n+]1nc2cc3c4c(c2c2cc(C)ccc21)CCCN4CCC3,O,500.0
CC[n+]1nc2cc3c4c(c2c2cc(F)ccc21)CCCN4CCC3,O,494.0
CC[n+]1nc2cc3c4c(c2c2ccccc21)CCCN4CCC3,O,493.0
CC[n+]1nc2ccc(N(C)C)cc2c2cc(C)ccc21,O,483.0
CCc1c(-c2ccc(/C=C(\C#N)C(=O)O)s2)sc(-c2ccc(N(c3ccccc3)c3ccccc3)s2)c1CC,ClCCl,450.0
CCc1c(-c2ccccc2)c2[o+]c(-c3ccccc3)c(CC)c3ccc4cccc1c4c32,ClCCl,465.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(/C=C/c5ccc(N(C)C)cc5)n4[B-]3(F)F)c3ccccc32)c1C,C1CCOC1,720.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(/C=C/c5ccc(N(C)C)cc5)n4[B-]3(F)F)c3ccccc32)c1C,CC#N,713.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(/C=C/c5ccc(N(C)C)cc5)n4[B-]3(F)F)c3ccccc32)c1C,CCCCCC,719.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(/C=C/c5ccc(N(C)C)cc5)n4[B-]3(F)F)c3ccccc32)c1C,CO,712.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(/C=C/c5ccc(N(C)C)cc5)n4[B-]3(F)F)c3ccccc32)c1C,Cc1ccccc1,730.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(/C=C/c5ccc(N(C)C)cc5)n4[B-]3(F)F)c3ccccc32)c1C,ClCCl,725.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(C)n4[B-]3(F)F)c3ccccc32)c1C,C1CCOC1,629.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(C)n4[B-]3(F)F)c3ccccc32)c1C,CC#N,620.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(C)n4[B-]3(F)F)c3ccccc32)c1C,CCCCCC,629.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(C)n4[B-]3(F)F)c3ccccc32)c1C,CO,623.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(C)n4[B-]3(F)F)c3ccccc32)c1C,Cc1ccccc1,636.0
CCc1c(C)[nH]c(C2=[N+]3C(=Cc4c(C)c(CC)c(C)n4[B-]3(F)F)c3ccccc32)c1C,ClCCl,629.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(C=C3c4ccccc4-c4ccccc43)C=CC1=C2C,C1CCCCC1,589.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(NCc3ccc(OC)cc3)C(SC#N)=CC1=C2C,CC#N,562.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(NCc3ccc(OC)cc3)C(SC#N)=CC1=C2C,CCCCCC,572.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(NCc3ccc(OC)cc3)C(SC#N)=CC1=C2C,CCOC(C)=O,565.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(NCc3ccc(OC)cc3)C(SC#N)=CC1=C2C,CO,562.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(NCc3ccc(OC)cc3)C(SC#N)=CC1=C2C,ClCCl,568.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(c3ccc[nH]3)c3ccccc3C1=C2C,C1CCOC1,604.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(c3ccc[nH]3)c3ccccc3C1=C2C,CC#N,597.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(c3ccc[nH]3)c3ccccc3C1=C2C,CCCCCC,604.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(c3ccc[nH]3)c3ccccc3C1=C2C,CO,599.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(c3ccc[nH]3)c3ccccc3C1=C2C,Cc1ccccc1,609.0
CCc1c(C)c2n(c1C)[B-](F)(F)[N+]1=C(c3ccc[nH]3)c3ccccc3C1=C2C,ClCCl,605.0
CCc1c(CC)c2n(c1C)[B-](F)(F)[N+]1=C(C)c3cc4c(cc3C1=C2)=[N+]1C(=Cc2c(CC)c(CC)c(C)n2[B-]1(F)F)C=4C,ClC(Cl)Cl,758.0
CCc1cc(C)cc(CC)c1N=Cc1cc(C)cc(C(c2ccccc2)c2ccccc2)c1O,Cc1ccccc1,347.0
CCc1cc(CC)cc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2cc(CC)cc(CC)c2)c1,ClC(Cl)Cl,410.0
CCc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,C1CCOC1,343.0
CCc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,CN(C)C=O,344.0
CCc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,Cc1ccccc1,354.0
CCc1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,ClC(Cl)Cl,344.0
CCc1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2ccc(CC)cc2)cc1,ClC(Cl)Cl,409.0
CCc1ccc(-n2c3ccccc3c3cc4c(cc32)c2ccccc2n4-c2ccc(CC)s2)s1,ClC(Cl)Cl,398.0
CCc1ccc(-n2cc3ccccc3c/c2=N/S(=O)(=O)c2ccc(C)cc2)cc1,CC#N,434.0
CCc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1[N+](=O)[O-],CS(C)=O,556.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CC#N,342.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CC(C)=O,347.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCC,341.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCCCCO,357.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCCO,357.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCO,354.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCO,347.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CN(C)C=O,355.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CO,326.0
CCc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CS(C)=O,350.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,C1CCCCC1,344.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,C1CCOC1,348.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,C1COCCO1,347.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CC#N,340.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CC(C)(C)O,350.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CC(C)O,347.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCCCCC,342.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCCCO,349.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCO,346.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCOC(C)=O,346.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CN(C)C=O,351.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CO,346.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CS(C)=O,352.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,ClC(Cl)Cl,343.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,ClCCl,341.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,O,354.0
CCc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,OCCO,346.0
CCc1ccc(C2=[N+]3C(=Cc4c5ccc(OC)cc5c(-c5ccc(CC)s5)n4[B-]3(F)F)c3ccc(OC)cc32)s1,ClCCl,727.0
CCc1ccc(N(c2ccc(CC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CN(C)C=O,486.0
CCc1ccc(N(c2ccc(CC)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CC#N,406.0
CCc1ccc(N(c2ccc(CC)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CCCCCC,406.0
CCc1ccc(N(c2ccc(CC)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CO,406.0
CCc1ccc(Nc2ccc3ccccc3n2)cc1,CCO,354.0
CCc1ccc(Nc2ccc3ccccc3n2)cc1,CCOC(C)=O,353.0
CCc1ccc(Nc2ccc3ccccc3n2)cc1,Cc1ccccc1,350.0
CCc1ccc2c(c1)C(=O)/C(=C\NS(=O)(=O)c1ccc(C)cc1)C(C(C)(C)C(=O)OC)O2,C1CCCCC1,364.0
CCc1ccc2c(c1)C(=O)/C(=C\NS(=O)(=O)c1ccc(C)cc1)C(C(C)(C)C(=O)OC)O2,CC#N,369.0
CCc1ccc2c(c1)C(=O)/C(=C\NS(=O)(=O)c1ccc(C)cc1)C(C(C)(C)C(=O)OC)O2,ClCCl,370.0
CCc1ccc2ccc(-c3ccccc3)nn12,C1CCCCC1,405.0
CCc1cccc(CC)c1-c1c2ccccc2c(-c2c(CC)cccc2CC)c2cc3ccccc3cc12,ClCCl,495.0
CCc1cccc(CC)c1-c1c2ccccc2c(C#Cc2ccccc2)c2cc3ccccc3cc12,ClCCl,523.0
CCc1cccc(CC)c1N=Cc1cc(C)cc(C(c2ccccc2)c2ccccc2)c1O,Cc1ccccc1,347.0
CCc1ccccc1C1=C2C=CC(=[N+](C)C)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,699.0
CCc1ccccc1C1=C2C=CC(=[N+]3CCCC3)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,703.0
CCc1coc2cc(O)ccc2c1=O,O,334.0
CCc1nccnc1C(=O)C=Cc1ccc(Br)cc1,CCO,305.0
CCc1nccnc1C(=O)C=Cc1ccc(N(C)C)cc1,CCO,295.0
CCc1nccnc1C(=O)C=Cc1ccc(OCc2ccccc2)cc1,CCO,250.0
CCc1nccnc1C(=O)C=Cc1ccc([N+](=O)[O-])cc1,CCO,295.0
CCc1nnc(N=Nc2c(-c3ccccc3)n(C)c3ccccc23)s1,CS(C)=O,450.0
CCc1s[c+](N2CCCCC2)sc1-c1cc(C)cc(I)c1[O-],C1CCOC1,409.0
CCc1s[c+](N2CCCCC2)sc1-c1cc(C)cc(I)c1[O-],CC#N,405.0
CCc1s[c+](N2CCCCC2)sc1-c1cc(C)cc(I)c1[O-],CO,360.0
CCc1s[c+](N2CCCCC2)sc1-c1cc(C)cc(I)c1[O-],ClCCl,406.0
CCn1c(-c2cc(-c3nc(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)c(-c4ccc5c(c4)C(CC)(CC)c4ccccc4-5)n3CC)c3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc(-c2ccc3c(c2)C(CC)(CC)c2ccccc2-3)c1-c1ccc2c(c1)C(CC)(CC)c1ccccc1-2,C1CCOC1,425.0
CCn1c(-c2cc(-c3nc(-c4ccccc4)c(-c4ccccc4)n3CC)c3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc(-c2ccccc2)c1-c1ccccc1,C1CCOC1,457.0
CCn1c(-c2cc(-c3nc(-c4ccccc4)c(-c4ccccc4)n3CC)c3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc(-c2ccccc2)c1-c1ccccc1,C1CCOC1,424.0
CCn1c(-c2ccc(-c3ccc(-c4ccc(-c5n(CC)c6cc(C)ccc6[n+]5CC)cc4)cc3)cc2)[n+](CC)c2ccc(C)cc21,O,307.0
CCn1c(-c2ccc(-c3ccc(-c4ccc(-c5n(CC)c6ccccc6[n+]5CC)cc4)c(C)c3)cc2)[n+](CC)c2ccccc21,O,290.0
CCn1c(-c2ccc(-c3ccc(-c4ccc(-c5n(CC)c6ccccc6[n+]5CC)cc4)cc3)cc2)[n+](CC)c2ccccc21,O,305.0
CCn1c(-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c(-c2ccc3ccccc3c2)c(-c2ccc3ccccc3c2)c1-c1ccc(-c2ccc3c(c2)C(C)(C)c2ccccc2-3)cc1,CCOC(C)=O,320.0
CCn1c(-c2ccc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc2)c(-c2ccc3ccccc3c2)c(-c2ccc3ccccc3c2)c1-c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)cc1,CCOC(C)=O,325.0
CCn1c(-c2ccc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)cc2)c(-c2ccc3ccccc3c2)c(-c2ccc3ccccc3c2)c1-c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1,CCOC(C)=O,326.0
CCn1c(-c2ccc(-c3ccc4ccc5cccc6ccc3c4c56)cc2)c(-c2ccc3ccccc3c2)c(-c2ccc3ccccc3c2)c1-c1ccc(-c2ccc3ccc4cccc5ccc2c3c45)cc1,CCOC(C)=O,344.0
CCn1c(-c2ccc(-c3cccc4ccccc34)cc2)c(-c2ccc3ccccc3c2)c(-c2ccc3ccccc3c2)c1-c1ccc(-c2cccc3ccccc23)cc1,CCOC(C)=O,292.0
CCn1c(-c2ccc(-c3ncc(/C=C(\C#N)C(=O)O)s3)s2)nc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,458.0
CCn1c(-c2ccc(/C=C(\C#N)C(=O)O)s2)nc(-c2ccc(N(C)C)cc2)c1-c1ccc(N(C)C)cc1,ClCCl,446.0
CCn1c(-c2ccc(/C=C(\C#N)C(=O)O)s2)nc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,434.0
CCn1c(-c2ccc(/C=C(\C#N)C(=O)O)s2)nc(-c2ccc3c(c2)C(CC)(CC)c2cc(N(c4ccccc4)c4ccccc4)ccc2-3)c1-c1ccc2c(c1)C(CC)(CC)c1cc(N(c3ccccc3)c3ccccc3)ccc1-2,ClCCl,430.0
CCn1c(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)c(-c2ccc3ccccc3c2)c(-c2ccc3ccccc3c2)c1-c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1,CCOC(C)=O,296.0
CCn1c(-c2ccc(OC)cc2)c(-c2ccc3ccccc3c2)c(-c2ccc3ccccc3c2)c1-c1ccc(OC)cc1,CCOC(C)=O,259.0
CCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)ccc2-3)nc(-c2ccccc2)c1-c1ccccc1,C1CCOC1,458.0
CCn1c(-c2ccc3c(c2)C(CC)(CC)c2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2-3)nc(-c2ccccc2)c1-c1ccccc1,C1CCOC1,425.0
CCn1c(=O)c2c(nc(/C=C/c3ccc(OC)c(OC)c3)n2C)n(CC)c1=O,ClCCl,362.0
CCn1c(=O)nc2n(C)c3cc(C)ccc3nc-2c1=O,C1COCCO1,443.0
CCn1c(=O)nc2n(C)c3cc(C)ccc3nc-2c1=O,CC#N,445.0
CCn1c(=O)nc2n(C)c3cc(C)ccc3nc-2c1=O,CO,446.0
CCn1c(=O)nc2n(C)c3cc(C)ccc3nc-2c1=O,ClCCCl,448.0
CCn1c(N)nc2ccccc21,CS(C)=O,310.0
CCn1c(SCC(=O)NN=Cc2cccc(OC)c2)nnc1-c1ccco1,CN(C)C=O,550.0
CCn1c2c(c3ccccc31)=NN(c1ccccc1)[B-](F)(F)[O+]=2,C1CCOC1,437.0
CCn1c2cc(-c3ccc(-c4cccs4)s3)ccc2c2ccc(-c3ccc(-c4cccs4)s3)cc21,ClCCl,399.0
CCn1c2cc(-c3cccs3)ccc2c2ccc(-c3cccs3)cc21,ClCCl,370.0
CCn1c2cc(C(C)(C)C)ccc2c2c3nsnc3c3c4ccc(C(C)(C)C)cc4n(CC)c3c21,CN(C)C=O,430.0
CCn1c2cc(C(C)(C)C)ccc2c2c3nsnc3c3c4ccc(C(C)(C)C)cc4n(CC)c3c21,Cc1ccccc1,425.0
CCn1c2cc(C(C)(C)C)ccc2c2c3nsnc3c3c4ccc(C(C)(C)C)cc4n(CC)c3c21,ClCCl,430.0
CCn1c2cc(OC)ccc2c2c3nsnc3c3c4ccc(OC)cc4n(CC)c3c21,CN(C)C=O,445.0
CCn1c2cc(OC)ccc2c2c3nsnc3c3c4ccc(OC)cc4n(CC)c3c21,Cc1ccccc1,439.0
CCn1c2cc(OC)ccc2c2c3nsnc3c3c4ccc(OC)cc4n(CC)c3c21,ClCCl,440.0
CCn1c2ccc(-c3ccc(-c4ccncc4)s3)cc2c2cc(-c3ccc(-c4ccc(N(c5ccc(-c6cccs6)cc5)c5ccc(-c6cccs6)cc5)cc4)s3)ccc21,ClC(Cl)Cl,372.0
CCn1c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)s3)cc2c2cc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)s3)ccc21,ClCCl,388.0
CCn1c2ccc(-c3ccc(C=C(c4ccc(N(C)C)cc4)c4ccc(N(C)C)cc4)cc3)cc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,ClC(Cl)Cl,445.0
CCn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2nc3cc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)ccc3nc21,CN(C)C=O,359.0
CCn1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2nc3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3nc21,CN(C)C=O,413.0
CCn1c2ccc(-c3ccc4c(c3)c3cc(-c5nc(-c6ccccc6)c(-c6ccccc6)n5-c5ccc(F)cc5)ccc3n4CC)cc2c2cc(-c3nc(-c4ccccc4)c(-c4ccccc4)n3-c3ccc(F)cc3)ccc21,CS(C)=O,314.0
CCn1c2ccc(-c3ccc4c(c3)c3cc(-c5nc(-c6ccccc6)c(-c6ccccc6)n5-c5ccc(OC)cc5)ccc3n4CC)cc2c2cc(-c3nc(-c4ccccc4)c(-c4ccccc4)n3-c3ccc(OC)cc3)ccc21,CS(C)=O,313.0
CCn1c2ccc(-c3cccnc3OC)cc2c2cc(-c3cccnc3OC)ccc21,C1CCOC1,302.0
CCn1c2ccc(-c3cccs3)cc2c2cc(-c3cccs3)ccc21,ClCCl,345.0
CCn1c2ccc(-c3ccncc3)cc2c2cc(-c3ccncc3)ccc21,C1CCOC1,327.0
CCn1c2ccc(/C=C(/C#N)C(=O)O)cc2c2ccc(-c3ccc(-c4ccc(-c5ccc(C=C(c6ccc(N(C)C)cc6)c6ccc(N(C)C)cc6)cc5)s4)s3)cc21,ClC(Cl)Cl,408.0
CCn1c2ccc(/C=C(/C#N)C(=O)O)cc2c2ccc(-c3ccc(-c4ccc(C=C(c5ccc(N(C)C)cc5)c5ccc(N(C)C)cc5)cc4)s3)cc21,ClC(Cl)Cl,400.0
CCn1c2ccc(/C=C(\C#N)c3ccccc3)cc2c2cc(/C=C(\C#N)c3ccccc3)ccc21,ClCCl,384.0
CCn1c2ccc(/C=C/c3ccc4c(c3)c3cc(-c5nc6ccccc6s5)ccc3n4CC)cc2c2cc(-c3nc4ccccc4s3)ccc21,C1CCOC1,361.0
CCn1c2ccc(/C=C/c3ccc4c(c3)c3cc(-c5nc6ccccc6s5)ccc3n4CC)cc2c2cc(-c3nc4ccccc4s3)ccc21,CCOC(C)=O,360.0
CCn1c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc3-4)cc2c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,C1CCOC1,506.0
CCn1c2ccc(N(c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)cc2c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,C1CCOC1,492.0
CCn1c2ccc(N=Nc3nc4ccc([N+](=O)[O-])cc4s3)cc2c2cc(N=Nc3nc4ccc([N+](=O)[O-])cc4s3)ccc21,CN(C)C=O,499.0
CCn1c2ccc(S(=O)(=O)O)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(S(=O)(=O)O)ccc1n3CCCCCC(=O)O,O,536.0
CCn1c2ccccc2c2c(C#N)c3c(ccc4c3cnn4C)nc21,CCOC(C)=O,383.0
CCn1c2ccccc2c2c(N(c3ccccc3)c3ccccc3)cccc21,ClCCl,357.0
CCn1c2ccccc2c2c1c1c3ccccc3n(CC)c1c1c3cc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)ccc3n(CC)c21,C1CCOC1,422.0
CCn1c2ccccc2c2c1c1c3ccccc3n(CC)c1c1c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc3n(CC)c21,C1CCOC1,476.0
CCn1c2ccccc2c2c1c1c3ccccc3n(CC)c1c1c3cc(-c4ccc(/C=C5\SC(=S)N(CC(=O)O)C5=O)s4)ccc3n(CC)c21,C1CCOC1,507.0
CCn1c2ccccc2c2c1c1c3ccccc3n(CC)c1c1c3cc(-c4ccc(C=C5SC(=S)N(CC(=O)O)C5=O)cc4)ccc3n(CC)c21,C1CCOC1,456.0
CCn1c2ccccc2c2c1c1c3ccccc3n(CC)c1c1c3cc(-c4ccc(C=C5SC(=S)N(CC(=O)O)C5=O)s4)ccc3n(CC)c21,C1CCOC1,507.0
CCn1c2ccccc2c2c3nsnc3c3c4ccccc4n(CC)c3c21,CN(C)C=O,420.0
CCn1c2ccccc2c2c3nsnc3c3c4ccccc4n(CC)c3c21,Cc1ccccc1,420.0
CCn1c2ccccc2c2c3nsnc3c3c4ccccc4n(CC)c3c21,ClCCl,420.0
CCn1c2ccccc2c2cc(-c3cc(-c4c(OC)cccc4OC)c(-c4sc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4-c4c(OC)cccc4OC)s3)ccc21,ClCCl,492.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(C#N)cc4)n3)ccc21,C1CCOC1,367.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(C#N)cc4)n3)ccc21,CCOC(C)=O,363.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(C#N)cc4)n3)ccc21,CN(C)C=O,370.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(C#N)cc4)n3)ccc21,Cc1ccccc1,366.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(C#N)cc4)n3)ccc21,ClCCl,365.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(OC)cc4)n3)ccc21,C1CCOC1,365.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(OC)cc4)n3)ccc21,CCOC(C)=O,362.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(OC)cc4)n3)ccc21,CN(C)C=O,369.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(OC)cc4)n3)ccc21,Cc1ccccc1,363.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccc(OC)cc4)n3)ccc21,ClCCl,364.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccccc4)n3)ccc21,C1CCOC1,364.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccccc4)n3)ccc21,CCOC(C)=O,360.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccccc4)n3)ccc21,CN(C)C=O,367.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccccc4)n3)ccc21,Cc1ccccc1,363.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(-c4ccccc4)n3)ccc21,ClCCl,363.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,C1CCOC1,381.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,CCOC(C)=O,378.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,CN(C)C=O,387.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,Cc1ccccc1,380.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,ClCCl,381.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(OC)n3)ccc21,C1CCOC1,366.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(OC)n3)ccc21,CCOC(C)=O,364.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(OC)n3)ccc21,CN(C)C=O,369.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(OC)n3)ccc21,Cc1ccccc1,365.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(OC)n3)ccc21,ClCCl,366.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,C1CCOC1,381.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,CCOC(C)=O,378.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,CN(C)C=O,384.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,Cc1ccccc1,382.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,ClCCl,384.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,C1CCOC1,360.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,CCOC(C)=O,359.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,CN(C)C=O,363.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,Cc1ccccc1,360.0
CCn1c2ccccc2c2cc(-c3cc(-c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,ClCCl,360.0
CCn1c2ccccc2c2cc(-c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)s4)s3)ccc21,ClC(Cl)Cl,443.0
CCn1c2ccccc2c2cc(-c3ccc(-c4ccc(-c5ccncn5)s4)s3)ccc21,CC#N,415.0
CCn1c2ccccc2c2cc(-c3ccc(-c4ccncn4)s3)ccc21,CC#N,385.0
CCn1c2ccccc2c2cc(-c3ccc(/C=C(\C#N)C(=O)O)s3)ccc21,CN(C)C=O,408.0
CCn1c2ccccc2c2cc(-c3ccc(C=C4C(=O)NC(=O)NC4=O)s3)ccc21,CCO,493.0
CCn1c2ccccc2c2cc(-c3nc(-c4ccccc4)c(-c4ccccc4)n3-c3ccc(F)cc3)ccc21,CS(C)=O,304.0
CCn1c2ccccc2c2cc(-c3nc(-c4ccccc4)c(-c4ccccc4)n3-c3ccc(OC)cc3)ccc21,Cc1ccccc1,305.0
CCn1c2ccccc2c2cc(-c3nc(-c4cccs4)c(-c4cccs4)n3-c3ccc(OC)cc3)ccc21,CS(C)=O,306.0
CCn1c2ccccc2c2cc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)ccc21,C1CCCCC1,457.0
CCn1c2ccccc2c2cc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)ccc21,C1CCOC1,496.0
CCn1c2ccccc2c2cc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)ccc21,CC(C)=O,496.0
CCn1c2ccccc2c2cc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)ccc21,CS(C)=O,512.0
CCn1c2ccccc2c2cc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)ccc21,Cc1ccccc1,498.0
CCn1c2ccccc2c2cc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)ccc21,ClC(Cl)Cl,514.0
CCn1c2ccccc2c2cc(/C=C/C3=C(C#N)C(=C(C#N)C#N)OC3(C)C)ccc21,ClCCl,510.0
CCn1c2ccccc2c2cc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)ccc21,C1CCOC1,465.0
CCn1c2ccccc2c2cc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)ccc21,CC(C)=O,458.0
CCn1c2ccccc2c2cc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)ccc21,CS(C)=O,472.0
CCn1c2ccccc2c2cc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)ccc21,Cc1ccccc1,463.0
CCn1c2ccccc2c2cc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)ccc21,ClC(Cl)Cl,468.0
CCn1c2ccccc2c2cc(/C=C/C3=C(Sc4ccccc4)C(=C(C#N)C#N)OC3(C)C)ccc21,ClCCl,464.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,C1CCOC1,406.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,CCOC(C)=O,402.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,CN(C)C=O,413.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,Cc1ccccc1,405.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,ClCCl,409.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,C1CCOC1,397.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,CCOC(C)=O,395.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,CN(C)C=O,405.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,Cc1ccccc1,397.0
CCn1c2ccccc2c2cc(/C=C/c3cc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)ncn3)ccc21,ClCCl,405.0
CCn1c2ccccc2c2cc(/C=C/c3cc(C)c4n3[B-](F)(F)[N+]3=C(/C=C/c5ccc6c7ccccc7n(CC)c6c5)C=C(C)C3=C4c3ccc(C(=O)O)cc3)ccc21,ClCCl,682.0
CCn1c2ccccc2c2cc(/C=C/c3cccc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)[n+]3CCCS(=O)(=O)[O-])ccc21,C1CCOC1,460.0
CCn1c2ccccc2c2cc(/C=C/c3cccc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)[n+]3CCCS(=O)(=O)[O-])ccc21,CC#N,454.0
CCn1c2ccccc2c2cc(/C=C/c3cccc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)[n+]3CCCS(=O)(=O)[O-])ccc21,CC(C)=O,458.0
CCn1c2ccccc2c2cc(/C=C/c3cccc(/C=C/c4ccc5c(c4)c4ccccc4n5CC)[n+]3CCCS(=O)(=O)[O-])ccc21,Cc1ccccc1,453.0
CCn1c2ccccc2c2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])ccc21,C1CCOC1,437.0
CCn1c2ccccc2c2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])ccc21,CC#N,423.0
CCn1c2ccccc2c2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])ccc21,CC(C)=O,425.0
CCn1c2ccccc2c2cc(/C=C/c3cccc[n+]3CCCS(=O)(=O)[O-])ccc21,Cc1ccccc1,424.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,C1CCOC1,446.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,C1COCCO1,443.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,CC#N,442.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,CC(C)=O,442.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,CCOC(C)=O,441.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,CN(C)C=O,449.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,CO,446.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,CS(C)=O,454.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,Cc1ccccc1,453.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,ClC(Cl)Cl,454.0
CCn1c2ccccc2c2cc(/C=C3\C(=O)c4ccccc4S3(=O)=O)ccc21,ClCCl,448.0
CCn1c2ccccc2c2cc(/C=C3\SC(=S)N(CC(=O)O)C3=O)c(OC)cc21,CC#N,494.0
CCn1c2ccccc2c2cc(/N=C/c3ccc(N(c4ccccc4)c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)ccc21,ClCCl,437.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,C1CCOC1,410.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,CCOC(C)=O,405.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,CN(C)C=O,411.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,Cc1ccccc1,410.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(C#N)n3)ccc21,ClCCl,415.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(N4CCCCC4)n3)ccc21,C1CCOC1,393.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(N4CCCCC4)n3)ccc21,CCOC(C)=O,391.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(N4CCCCC4)n3)ccc21,CN(C)C=O,398.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(N4CCCCC4)n3)ccc21,Cc1ccccc1,395.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(N4CCCCC4)n3)ccc21,ClCCl,397.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,C1CCOC1,408.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,CCOC(C)=O,405.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,CN(C)C=O,415.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,Cc1ccccc1,411.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(S(C)(=O)=O)n3)ccc21,ClCCl,417.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,C1CCOC1,396.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,CCOC(C)=O,392.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,CN(C)C=O,399.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,Cc1ccccc1,396.0
CCn1c2ccccc2c2cc(C#Cc3cc(C#Cc4ccc5c(c4)c4ccccc4n5CC)nc(SC)n3)ccc21,ClCCl,396.0
CCn1c2ccccc2c2cc(C(=O)OC)nc(-c3nc4ccccc4s3)c21,ClC(Cl)Cl,384.12
CCn1c2ccccc2c2cc(C3=CC(c4ccc5c(c4)c4ccccc4n5CC)=[O+][B-](F)(F)O3)ccc21,C1CCOC1,460.0
CCn1c2ccccc2c2cc(C3=CC(c4ccc5c(c4)c4ccccc4n5CC)=[O+][B-](F)(F)O3)ccc21,CC(C)=O,464.0
CCn1c2ccccc2c2cc(C3=CC(c4ccc5c(c4)c4ccccc4n5CC)=[O+][B-](F)(F)O3)ccc21,CO,463.0
CCn1c2ccccc2c2cc(C3=CC(c4ccc5c(c4)c4ccccc4n5CC)=[O+][B-](F)(F)O3)ccc21,Cc1ccccc1,460.0
CCn1c2ccccc2c2cc(C3=CC(c4ccc5c(c4)c4ccccc4n5CC)=[O+][B-](F)(F)O3)ccc21,ClC(Cl)Cl,466.0
CCn1c2ccccc2c2cc(C3=CC(c4ccc5c(c4)c4ccccc4n5CC)=[O+][B-](F)(F)O3)ccc21,ClCCl,467.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(C)=C3)ccc21,C1CCOC1,400.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(C)=C3)ccc21,CC(C)=O,402.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(C)=C3)ccc21,CO,401.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(C)=C3)ccc21,Cc1ccccc1,402.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(C)=C3)ccc21,ClC(Cl)Cl,406.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(C)=C3)ccc21,ClCCl,406.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(c4ccc(OC)cc4)=C3)ccc21,C1CCOC1,440.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(c4ccc(OC)cc4)=C3)ccc21,CC(C)=O,442.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(c4ccc(OC)cc4)=C3)ccc21,CO,441.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(c4ccc(OC)cc4)=C3)ccc21,Cc1ccccc1,440.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(c4ccc(OC)cc4)=C3)ccc21,ClC(Cl)Cl,443.0
CCn1c2ccccc2c2cc(C3=[O+][B-](F)(F)OC(c4ccc(OC)cc4)=C3)ccc21,ClCCl,445.0
CCn1c2ccccc2c2cc(C=C(C#N)C(=O)O)ccc21,CC#N,385.0
CCn1c2ccccc2c2cc(C=CC(=O)c3c(O)c4ccccc4oc3=O)ccc21,CO,467.0
CCn1c2ccccc2c2cc(C=CC3=[O+][B-](F)(F)Oc4c3c(=O)oc3ccccc43)ccc21,CC#N,462.0
CCn1c2ccccc2c2cc(C=Cc3ccc(SC)cc3)ccc21,CN(C)C=O,337.0
CCn1c2ccccc2c2cc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc3-4)ccc21,C1CCOC1,473.0
CCn1c2ccccc2c2cc(N(c3ccc4c(c3)C(CC)(CC)c3ccccc3-4)c3ccc4c(c3)C(CC)(CC)c3cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc3-4)ccc21,C1CCOC1,474.0
CCn1c2ccccc2c2cc(N3C(=O)c4cccc5c(-c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)s7)s6)ccc(c45)C3=O)ccc21,ClCCl,443.0
CCn1c2ccccc2c2cc(N3C(=O)c4cccc5c(-c6ccc(/C=C(\C#N)C(=O)O)cc6)ccc(c45)C3=O)ccc21,ClCCl,356.0
CCn1c2ccccc2c2cc(N3c4ccccc4Sc4cc(/C=C(\C#N)C(=O)O)ccc43)ccc21,ClCCl,471.0
CCn1c2ccccc2c2cc3c(cc21)c1ccccc1n3CC,ClC(Cl)Cl,419.0
CCn1c2ccccc2c2ccc(-c3ccc(OC)cc3)cc21,C1CCCCC1,310.0
CCn1c2ccccc2c2ccc(-n3c4ccccc4c4ccccc43)cc21,C1CCOC1,339.0
CCn1c2ccccc2c2ccc(C#N)cc21,C1CCCCC1,366.0
CCn1c2ccccc2c2ccc(C3CC4C(=C5SC(c6ccc(C=C(C#N)C(=O)O)s6)CC5C5C6CCCC5OCCCCCCOC5CCCC(OCCCCCCO6)C54)S3)cc21,ClCCl,550.0
CCn1c2ccccc2c2cccc(N(c3ccccc3)c3ccccc3)c21,ClCCl,353.0
CCn1c2ccccc2c2nc3cc(C(=O)OC)c(C(=O)OC)cc3nc21,CN(C)C=O,410.0
CCn1c2ccccc2c2nc3cc4c(=O)[nH][nH]c(=O)c4cc3nc21,CN(C)C=O,408.0
CCn1c2ccccc2c2nc3ccc(C(=O)OC)c(C(=O)OC)c3nc21,CN(C)C=O,406.0
CCn1c2ccccc2c2nc3ccc4c(=O)[nH][nH]c(=O)c4c3nc21,CN(C)C=O,401.0
CCn1c2ccccc2oc2c(C#N)c3c(oc4ccccc4n3CC)c(C#N)c21,ClC(Cl)Cl,495.0
CCn1c2ccccc2oc2c(C#N)c3oc4ccccc4oc3c(C#N)c21,ClC(Cl)Cl,470.0
CCn1c2ccccc2sc2c(C#N)c3[nH]c4ccccc4sc3c(C#N)c21,ClC(Cl)Cl,495.0
CCn1c2ccccc2sc2c(C#N)c3oc4ccccc4oc3c(C#N)c21,ClC(Cl)Cl,460.0
CCn1c2ccsc2c2c3nsnc3c3c4sccc4n(CC)c3c21,C1CCOC1,436.0
CCn1c2ccsc2c2c3nsnc3c3c4sccc4n(CC)c3c21,CCOC(C)=O,433.0
CCn1c2ccsc2c2c3nsnc3c3c4sccc4n(CC)c3c21,CN(C)C=O,441.0
CCn1c2ccsc2c2c3nsnc3c3c4sccc4n(CC)c3c21,Cc1ccccc1,432.0
CCn1c2ccsc2c2c3nsnc3c3c4sccc4n(CC)c3c21,ClCCl,436.0
CCn1c2sccc2c2c3nsnc3c3c4ccsc4n(CC)c3c21,C1CCOC1,424.0
CCn1c2sccc2c2c3nsnc3c3c4ccsc4n(CC)c3c21,CCOC(C)=O,422.0
CCn1c2sccc2c2c3nsnc3c3c4ccsc4n(CC)c3c21,CN(C)C=O,430.0
CCn1c2sccc2c2c3nsnc3c3c4ccsc4n(CC)c3c21,Cc1ccccc1,423.0
CCn1c2sccc2c2c3nsnc3c3c4ccsc4n(CC)c3c21,ClCCl,425.0
CCn1cc(C=C(C#N)C#N)c2ccccc21,CO,400.0
CCn1cc(C=C(C#N)c2nc3ccccc3[nH]2)c2ccccc21,Cc1ccccc1,422.0
CCn1cc(C=CC(=C(C#N)C#N)c2ccccc2)c2ccccc21,Cc1ccccc1,469.0
CCn1ncc2c3c(C#N)c4c5ccccc5n(C)c4nc3ccc21,CCOC(C)=O,383.0
CF,C1CCCCC1,277.0
CN(/N=C1\N=C(N)C2(CCCC2)c2ccccc21)c1ccccc1,ClCCl,378.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,C1CCOC1,459.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CCCCCC,437.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CCO,471.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CCOC(C)=O,459.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CN(C)C=O,479.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,CO,470.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,Cc1ccccc1,454.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,ClC(Cl)(Cl)Cl,448.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,ClC(Cl)Cl,464.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,ClCCl,467.0
CN(C)/C=N\c1ccc2c3c(cccc13)C(=O)c1ccccc1-2,c1ccccc1,456.0
CN(C)C#Cc1ccc(C2=C3C(=O)N(Cc4ccccc4)C(c4ccc(C(=O)O)cc4)=C3C(=O)N2Cc2ccccc2)cc1,C1CCOC1,488.0
CN(C)C(=CC=Cc1ccccc1)c1ccc(C#N)cc1,CCCCCC,410.0
CN(C)C(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,C1CCCCC1,368.0
CN(C)C(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CC#N,373.0
CN(C)C(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CC(C)O,377.0
CN(C)C(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CO,377.0
CN(C)C(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CS(C)=O,383.0
CN(C)C(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,ClC(Cl)Cl,377.0
CN(C)C(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,c1ccccc1,376.0
CN(C)C1=Nc2cccc3cccc1c23,CC#N,427.0
CN(C)C=O,CS(C)=O,469.0
CN(C)CCCN1c2ccccc2CCc2ccccc21,CC#N,276.0
CN(C)CCCN1c2ccccc2CCc2ccccc21,CO,274.0
CN(C)CCCN1c2ccccc2CCc2ccccc21,O,275.0
CN(C)CCCN1c2ccccc2Sc2ccccc21,CC#N,305.0
CN(C)CCCN1c2ccccc2Sc2ccccc21,CO,307.0
CN(C)CCCN1c2ccccc2Sc2ccccc21,O,302.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C1CCCCC1,340.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C1CCOC1,351.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CC#N,347.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CC(C)=O,352.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CCO,341.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CN(C)C=O,340.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CO,341.0
CN(C)CCN(Cc1c2ccccc2c(CN(CCN(C)C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],ClC(Cl)Cl,342.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,C1CCCCC1,390.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,C1CCOC1,393.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,CC#N,394.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,CC(C)=O,393.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,CCO,391.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,CN(C)C=O,398.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,CO,391.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,395.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C1CCCCC1,372.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C1CCOC1,394.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CC#N,392.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CC(C)=O,392.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CCO,394.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CN(C)C=O,395.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CO,391.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CS(C)=O,397.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],ClC(Cl)Cl,393.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-],ClCCl,394.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,C1CCCCC1,389.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,C1CCOC1,391.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,CC#N,390.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,CC(C)=O,390.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,CCO,371.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,CN(C)C=O,391.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,CO,370.0
CN(C)CCN(Cc1c2ccccc2cc2ccccc12)c1ccc([N+](=O)[O-])cn1,ClC(Cl)Cl,393.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,C1CCCCC1,368.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,C1CCOC1,366.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,CC#N,365.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,CC(C)=O,365.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,CCO,366.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,CN(C)C=O,363.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,CO,364.0
CN(C)CCNCc1c2ccccc2cc2ccccc12,ClC(Cl)Cl,367.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C1CCCCC1,334.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C1CCOC1,352.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],C1COCCO1,348.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CC#N,352.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CC(C)=O,352.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CCCCCC,330.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CCO,348.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CCOC(C)=O,347.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CN(C)C=O,358.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CO,350.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CS(C)=O,363.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],Cc1ccccc1,347.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],ClC(Cl)Cl,350.0
CN(C)CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],ClCCl,352.0
CN(C)CCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(O)cc1)C2=O,CC#N,430.0
CN(C)CCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(O)cc1)C2=O,CN(C)C=O,436.0
CN(C)CCNc1ccc2c3c(cccc13)C(=O)N(c1ccc(O)cc1)C2=O,ClC(Cl)Cl,430.0
CN(C)[C@@H]1C(=O)C(=C(N)O)C(=O)[C@@]2(O)C(=O)C3=C(O)c4c(O)ccc(Cl)c4[C@@H](O)[C@H]3C[C@@H]12,CCO,480.0
CN(C)[C@@H]1C(=O)C(=C(N)O)C(=O)[C@@]2(O)C(=O)C3=C(O)c4c(O)ccc(Cl)c4[C@@](C)(O)[C@H]3C[C@@H]12,CS(C)=O,480.0
CN(C)[c+]1scc(-c2cc(I)cc(I)c2[O-])s1,C1CCOC1,438.0
CN(C)[c+]1scc(-c2cc(I)cc(I)c2[O-])s1,CC#N,425.0
CN(C)[c+]1scc(-c2cc(I)cc(I)c2[O-])s1,CO,394.0
CN(C)[c+]1scc(-c2cc(I)cc(I)c2[O-])s1,ClCCl,430.0
CN(C)c1[se]c(-c2ccc(Cl)cc2)nc1-c1ccccc1,ClC(Cl)Cl,360.0
CN(C)c1[se]c(-c2ccccc2)nc1-c1ccccc1,ClC(Cl)Cl,326.0
CN(C)c1c2ccccc2cc2ccccc12,C1CCCCC1,386.0
CN(C)c1c2ccccc2cc2ccccc12,C1CCOC1,386.0
CN(C)c1c2ccccc2cc2ccccc12,C1COCCO1,387.0
CN(C)c1c2ccccc2cc2ccccc12,CC#N,386.0
CN(C)c1c2ccccc2cc2ccccc12,CCO,385.0
CN(C)c1c2ccccc2cc2ccccc12,CN(C)C=O,388.0
CN(C)c1c2ccccc2cc2ccccc12,CO,384.0
CN(C)c1c2ccccc2cc2ccccc12,COCCOC,386.0
CN(C)c1c2ccccc2cc2ccccc12,CS(C)=O,390.0
CN(C)c1c2ccccc2cc2ccccc12,O,385.0
CN(C)c1c2ccccc2cc2ccccc12,OCC(O)CO,393.0
CN(C)c1c2ccccc2cc2ccccc12,OCCO,388.0
CN(C)c1cc(-c2ccc(C#Cc3cc[n+](C)cc3)cc2)cc2ccccc12,ClCCl,366.0
CN(C)c1cc(-c2ccc(C#Cc3ccccc3)cc2)cc2ccccc12,CC#N,302.5763359
CN(C)c1cc(-c2ccc(C#Cc3ccccc3)cc2)cc2ccccc12,CCO,300.2862595
CN(C)c1cc(-c2ccc(C#Cc3ccccc3)cc2)cc2ccccc12,ClCCl,304.0
CN(C)c1cc(-c2ccc(C#Cc3ccncc3)cc2)cc2ccccc12,CC#N,306.2600321
CN(C)c1cc(-c2ccc(C#Cc3ccncc3)cc2)cc2ccccc12,CCO,309.3900482
CN(C)c1cc(-c2ccc(C#Cc3ccncc3)cc2)cc2ccccc12,ClCCl,311.0
CN(C)c1cc(-c2ccccc2)cc2cc(C#Cc3ccncc3)ccc12,ClCCl,345.0
CN(C)c1cc(-c2ccccc2)cc2ccccc12,ClCCl,318.0
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,C1CCCCC1,387.4467261
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,C1CCOC1,390.4724717
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,C1COCCO1,391.0833007
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CC#N,390.9304144
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CC(C)=O,389.8635478
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CC(C)OC(C)C,386.6976025
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CC1COC(=O)O1,394.4773176
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCC#N,391.0833007
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCC(C)C,385.2080123
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCCCCC,386.6976025
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCCCCCCCO,393.3910307
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCCCCOCCCCC,388.5003885
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCCCOC(C)=O,389.8635478
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCCCOCCCC,387.5968992
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCCOCCC,389.8635478
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCO,391.6960439
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCOC(C)=O,389.7116134
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CCOCC,390.625
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CN(C)C=O,393.5458481
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CO,392.3107101
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,CS(C)=O,396.8253968
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,Cc1ccccc1,395.256917
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,ClCCCl,394.4773176
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,ClCCl,397.2983711
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,N#Cc1ccccc1,399.3610224
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,O,386.8471954
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,OCC(O)CO,403.3884631
CN(C)c1cc(C#N)c(N(C)C)c(C#N)c1,c1ccccc1,395.7261575
CN(C)c1cc(F)c(C(=O)c2cc(F)c(N(C)C)cc2F)cc1F,CCO,358.0
CN(C)c1cc2c(cc1F)c(=O)c1cc(F)c(N)cc1n2C,CCO,369.0
CN(C)c1cc2oc3cc(=[N+](C)C)c(-c4ccccc4)cc-3c(-c3ccccc3C(=O)[O-])c2cc1-c1ccccc1,CO,548.0
CN(C)c1ccc(-c2c(/C=C3/C=Cc4ccccc4N3C)c(=O)c2=O)cc1,C1CCCCC1,358.0
CN(C)c1ccc(-c2c(/C=C3/C=Cc4ccccc4N3C)c(=O)c2=O)cc1,Cc1ccccc1,362.0
CN(C)c1ccc(-c2c(/C=C3/C=Cc4ccccc4N3C)c(=O)c2=O)cc1,ClCCl,509.0
CN(C)c1ccc(-c2c(/C=C3/C=Cc4ccccc4N3Cc3ccccc3)c(=O)c2=O)cc1,C1CCCCC1,358.0
CN(C)c1ccc(-c2c(/C=C3/C=Cc4ccccc4N3Cc3ccccc3)c(=O)c2=O)cc1,Cc1ccccc1,364.0
CN(C)c1ccc(-c2c(/C=C3/C=Cc4ccccc4N3Cc3ccccc3)c(=O)c2=O)cc1,ClCCl,511.0
CN(C)c1ccc(-c2c(F)c(F)c(-c3ccc(N(C)C)cc3)c(F)c2F)cc1,ClCCl,331.0
CN(C)c1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(C)C)ccc23)cc1,O,525.0
CN(C)c1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)cc1,O,535.0
CN(C)c1ccc(-c2c3ccc(=[NH2+])cc-3sc3cc(N)ccc23)cc1,O,520.0
CN(C)c1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,C1CCCCC1,288.0
CN(C)c1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,CC#N,292.0
CN(C)c1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,CCOC(C)=O,290.0
CN(C)c1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,CCOCC,289.0
CN(C)c1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,CN(C)C=O,295.0
CN(C)c1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,Cc1ccccc1,292.0
CN(C)c1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,ClCCl,292.0
CN(C)c1ccc(-c2cc(-c3ccc(C(F)(F)F)cc3)nn2C)cc1,ClCCl,283.0
CN(C)c1ccc(-c2cc(-c3ccc(N(C)C)cc3)ncn2)cc1,ClCCl,378.0
CN(C)c1ccc(-c2cc(-c3ccc4ccccc4c3)nc(-c3ccccc3)n2)cc1,C1CCCCC1,368.0
CN(C)c1ccc(-c2cc(-c3ccc4ccccc4c3)nc(-c3ccccc3)n2)cc1,CS(C)=O,382.0
CN(C)c1ccc(-c2cc(-c3ccc4ccccc4c3)nc(-c3ccccc3)n2)cc1,ClC(Cl)Cl,379.0
CN(C)c1ccc(-c2cc(-c3cccs3)nc(-c3ccccc3)n2)cc1,ClC(Cl)Cl,371.0
CN(C)c1ccc(-c2cc(=O)c3ccccc3o2)cc1,C1CCCCC1,351.0
CN(C)c1ccc(-c2cc(=O)c3ccccc3o2)cc1,CC#N,373.0
CN(C)c1ccc(-c2cc(=O)c3ccccc3o2)cc1,CCOC(C)=O,366.0
CN(C)c1ccc(-c2cc(=O)c3ccccc3o2)cc1,Cc1ccccc1,362.0
CN(C)c1ccc(-c2cc3c(ccc4c([N+](=O)[O-])cccc43)c(=O)o2)cc1,CCOC(C)=O,435.0
CN(C)c1ccc(-c2cc3c(ccc4c([N+](=O)[O-])cccc43)c(=O)o2)cc1,CO,439.0
CN(C)c1ccc(-c2cc3c(s2)c(C(=O)c2ccccc2)cc(=O)n3Cc2ccccc2)cc1,CC#N,438.0
CN(C)c1ccc(-c2cc3c(s2)c(C(=O)c2ccccc2)cc(=O)n3Cc2ccccc2)cc1,ClCCl,446.0
CN(C)c1ccc(-c2ccc(-c3cc(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c3-c3ccccc3)nc2)cc1,ClC(Cl)Cl,332.0
CN(C)c1ccc(-c2ccc(-c3cc(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c3-c3ccccc3)s2)cc1,ClC(Cl)Cl,362.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)cc2)cc1,C1CCCCC1,353.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)cc2)cc1,C1CCOC1,342.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)cc2)cc1,CN(C)C=O,350.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)cc2)cc1,CS(C)=O,342.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)cc2)cc1,Cc1ccccc1,360.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)cc2)cc1,ClC(Cl)Cl,348.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)s2)cc1,C1CCCCC1,368.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)s2)cc1,C1CCOC1,350.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)s2)cc1,CN(C)C=O,384.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)s2)cc1,CS(C)=O,379.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)s2)cc1,Cc1ccccc1,377.0
CN(C)c1ccc(-c2ccc(-c3cc(N4CCCCC4)c(C#N)c4c3-c3ccccc3CC4)s2)cc1,ClC(Cl)Cl,377.0
CN(C)c1ccc(-c2ccc(-c3ncc4ccccn34)cc2)cc1,ClC(Cl)Cl,348.0
CN(C)c1ccc(-c2ccc(/C=C(\C#N)c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)s3)cc2)cc1,CN(C)C=O,488.0
CN(C)c1ccc(-c2ccc(/C=C/c3ccncn3)cc2)cc1,ClCCl,386.0
CN(C)c1ccc(-c2ccc(C3=C4C(=O)N(C(=O)OC(C)(C)C)C(c5ccc(-c6ccc(N(C)C)cc6)cc5)=C4C(=O)N3C(=O)OC(C)(C)C)cc2)cc1,ClCCl,518.0
CN(C)c1ccc(-c2ccc(C3=C4C(=O)NC(c5ccc(-c6ccc(N(C)C)cc6)cc5)=C4C(=O)N3)cc2)cc1,ClCCl,566.0
CN(C)c1ccc(-c2ccc(C=O)cc2)cc1,C1CCOC1,368.0
CN(C)c1ccc(-c2ccc(C=O)cc2)cc1,CC#N,368.0
CN(C)c1ccc(-c2ccc(C=O)cc2)cc1,CCCCCC,368.0
CN(C)c1ccc(-c2ccc(C=O)cc2)cc1,CN(C)C=O,368.0
CN(C)c1ccc(-c2ccc(C=O)cc2)cc1,CO,368.0
CN(C)c1ccc(-c2ccc(C=O)cc2)cc1,Cc1ccccc1,368.0
CN(C)c1ccc(-c2ccc(C=O)cc2)cc1,ClCCl,368.0
CN(C)c1ccc(-c2ccc(N(c3ccc(-c4ccc(N(C)C)cc4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)cc1,CCO,482.0
CN(C)c1ccc(-c2ccc(N(c3ccc(-c4ccc(N(C)C)cc4)cc3)c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3)cc2)cc1,CCO,485.0
CN(C)c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3)cc2)cc1,ClCCl,460.0
CN(C)c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4sc(C=C(C#N)C(=O)O)c5c4OCCO5)cc3)cc2)cc1,ClCCl,477.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,C1COCCO1,678.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,CC#N,674.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,CCCCCC,665.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,CCCCO,679.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,CCCCOCCCC,675.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,CCO,678.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,CCOC(C)=O,677.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,CS(C)=O,697.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,Cc1ccccc1,683.0
CN(C)c1ccc(-c2ccc3n2[B-](F)(F)[N+]2=C(c4ccccc4)C=CC2=C3C(F)(F)F)cc1,ClC(Cl)(Cl)Cl,676.0
CN(C)c1ccc(-c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,325.0
CN(C)c1ccc(-c2ccnc3nc(-c4ccc(C#N)cc4)nn23)cc1,ClCCl,402.0
CN(C)c1ccc(-c2ccnc3ncnn23)cc1,ClCCl,389.0
CN(C)c1ccc(-c2cnc(-c3ccc(C(=O)ON4C(=O)C=CC4=O)cc3)o2)cc1,CO,395.0
CN(C)c1ccc(-c2nc(-c3ccc(-c4ccc([N+](=O)[O-])cc4)cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,417.0
CN(C)c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,C1CCOC1,345.0
CN(C)c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,CN(C)C=O,348.0
CN(C)c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,Cc1ccccc1,353.0
CN(C)c1ccc(-c2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,ClC(Cl)Cl,348.0
CN(C)c1ccc(-c2nc(-c3ccc(C#Cc4ccc(C#N)cc4)cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,405.0
CN(C)c1ccc(-c2nc(-c3ccc(C#Cc4ccc([N+](=O)[O-])cc4)cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,420.0
CN(C)c1ccc(-c2nc(-c3ccc(C=Cc4ccc(C#N)cc4)cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,407.0
CN(C)c1ccc(-c2nc(-c3ccc(C=Cc4ccc([N+](=O)[O-])cc4)cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,434.0
CN(C)c1ccc(-c2nc(-c3ccc(N(C)C)cc3)c3ccccc3n2)cc1,ClCCl,384.0
CN(C)c1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,C1CCCCC1,315.0
CN(C)c1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,CC#N,345.0
CN(C)c1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,CO,315.0
CN(C)c1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,ClCCl,372.0
CN(C)c1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,O,341.0
CN(C)c1ccc(-c2nc(-c3ccccc3)n3ccccc23)cc1,ClC(Cl)Cl,314.0
CN(C)c1ccc(-c2nc(C#N)c(C#N)n2C)cc1,C1CCCCC1,323.0
CN(C)c1ccc(-c2nc(C#N)c(C#N)n2C)cc1,CC#N,313.0
CN(C)c1ccc(-c2nc(C#N)c(C#N)n2C)cc1,CO,309.0
CN(C)c1ccc(-c2nc(C#N)c(C#N)n2C)cc1,ClC(Cl)Cl,326.0
CN(C)c1ccc(-c2nc(C=CC=Cc3ccc(C#N)cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,442.0
CN(C)c1ccc(-c2nc(C=Cc3ccc(C#N)cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,434.0
CN(C)c1ccc(-c2nc(C=Cc3ccc([N+](=O)[O-])cc3)[nH]c2-c2ccc(N(C)C)cc2)cc1,ClCCl,470.0
CN(C)c1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,C1CCOC1,493.0
CN(C)c1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CCCCCC,470.0
CN(C)c1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,Cc1ccccc1,491.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1,ClC(Cl)Cl,430.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,C1CCOC1,344.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CC#N,343.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CCCCCC,348.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CCOC(C)=O,333.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CO,332.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CS(C)=O,346.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,Cc1ccccc1,344.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,ClCCl,342.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,C1CCOC1,348.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CCCCCC,346.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CCOC(C)=O,338.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CO,342.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CS(C)=O,350.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,Cc1ccccc1,351.0
CN(C)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClCCl,347.0
CN(C)c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1,CC#N,325.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,C1CCCCC1,327.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,C1CCOC1,332.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,C1COCCO1,331.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,CC#N,335.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,CCCCO,339.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,CCCO,339.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,CCO,340.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,CCOC(C)=O,332.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,CCOCC,328.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,CO,341.0
CN(C)c1ccc(-c2nc3cnccc3[nH]2)cc1,O,335.0
CN(C)c1ccc(-c2nc3nc4ccccc4nc3n2-c2ccc(C(C)(C)C)cc2)cc1,CC#N,411.0
CN(C)c1ccc(-c2nc3nc4ccccc4nc3n2-c2ccccc2)cc1,CC#N,411.0
CN(C)c1ccc(-c2nc3nccc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3n2)cc1,ClCCl,402.0
CN(C)c1ccc(-c2nc3nccc(-c4ccc(C#N)cc4)n3n2)cc1,ClCCl,400.0
CN(C)c1ccc(-c2nc3nccc(-c4ccc(Cl)cc4)n3n2)cc1,ClCCl,378.0
CN(C)c1ccc(-c2nc3ncccn3n2)cc1,ClCCl,358.0
CN(C)c1ccc(-c2nc3nccnc3n2-c2ccc(N(C)C)cc2)cc1,CC#N,371.0
CN(C)c1ccc(-c2nc3nccnc3n2-c2ccccc2)cc1,CC#N,371.0
CN(C)c1ccc(-c2nnc3ccccn23)cc1,ClCCl,301.0
CN(C)c1ccc(-c2oc3cccc4[n+]3c2-c2ccccc2-4)cc1,ClCCl,506.0
CN(C)c1ccc(-c2sc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)c3c2OCCO3)cc1,C1CCOC1,444.0
CN(C)c1ccc(-c2sc(-c3ccc(/C=C(\C#N)C(=O)O)o3)c3c2OCCO3)cc1,C1CCOC1,457.0
CN(C)c1ccc(-c2sc(-c3ccc(/C=C(\C#N)C(=O)O)s3)c3c2OCCO3)cc1,C1CCOC1,483.0
CN(C)c1ccc(-n2c(-c3ccc(C#N)cc3)nc3ccccc32)cc1,CC#N,308.0
CN(C)c1ccc(-n2c(-c3ccncc3)nc3ccccc32)cc1,CC#N,299.0
CN(C)c1ccc(-n2c(-c3ccncc3)nc3nccnc32)cc1,CC#N,309.0
CN(C)c1ccc(-n2c3ccccc3c3cc(/C=C(\C#N)C(=O)O)ccc32)cc1,CC#N,425.0
CN(C)c1ccc(-n2c3ccccc3c3cc(/C=C/C(=O)O)ccc32)cc1,CC#N,413.0
CN(C)c1ccc(-n2nc(C(=O)c3ccccc3)c(-c3ccccc3)n2)cc1,C1CCOC1,335.0
CN(C)c1ccc(-n2ncc(-c3ccccc3)n2)cc1,C1CCOC1,316.0
CN(C)c1ccc(/C=C(\C#N)c2nc3ccccc3s2)cc1,C1CCCCC1,430.0
CN(C)c1ccc(/C=C(\C#N)c2nc3ccccc3s2)cc1,CO,450.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,C1CCOC1,488.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,CC#N,494.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,CC(C)=O,492.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,CCOC(C)=O,497.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,CN(C)C=O,505.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,CO,496.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,Cc1ccccc1,487.0
CN(C)c1ccc(/C=C/C(=C(C#N)C#N)c2ccc3c4c(cccc24)CC3)cc1,ClC(Cl)Cl,483.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,C1CCCCC1,358.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,C1CCOC1,358.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,C1COCCO1,356.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,CC#N,364.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,CCCCO,356.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,CCCO,355.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,CCOC(C)=O,358.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,CO,357.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,Cc1ccccc1,362.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,O,323.0
CN(C)c1ccc(/C=C/C(=O)O)cc1,c1ccccc1,365.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,C1CCOC1,413.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,CC#N,419.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,CC(=O)O,430.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,CC(C)=O,418.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,CCO,429.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,CN(C)C=O,427.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,CO,428.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,Cc1ccccc1,416.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,ClC(Cl)Cl,426.0
CN(C)c1ccc(/C=C/C(=O)c2ccc(Cl)cc2)cc1,c1ccccc1,420.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,C1CCOC1,404.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,CC#N,410.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,CC(=O)O,423.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,CC(C)=O,407.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,CCO,420.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,CN(C)C=O,419.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,CO,421.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,Cc1ccccc1,406.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,ClC(Cl)Cl,417.0
CN(C)c1ccc(/C=C/C(=O)c2ccccc2)cc1,c1ccccc1,407.0
CN(C)c1ccc(/C=C/C2=C/C(=C(\C#N)C(=O)O)CC(C)(C)C2)cc1,CC#N,464.0
CN(C)c1ccc(/C=C/C2=[N+](CCCS(=O)(=O)[O-])c3ccccc3C2(C)C)cc1,CO,557.0
CN(C)c1ccc(/C=C/C2=[N+](CCCS(=O)(=O)[O-])c3ccccc3C2(C)C)cc1,ClC(Cl)Cl,557.0
CN(C)c1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,C1COCCO1,352.0
CN(C)c1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,CC#N,349.0
CN(C)c1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,CO,343.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,C1CCOC1,407.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,C1COCCO1,406.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,CC#N,405.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,CC(C)=O,405.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,CC1CCCCC1,400.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,CCCCCC,396.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,CCOCC,399.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,CN(C)C=O,412.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,CO,401.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,Cc1ccccc1,410.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,ClC(Cl)(Cl)Cl,408.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,410.0
CN(C)c1ccc(/C=C/C=C/C=C/c2ccc(N(C)C)cc2)cc1,ClCCl,410.0
CN(C)c1ccc(/C=C/C=C/c2ccc(C#N)cc2)cc1,CC#N,402.0
CN(C)c1ccc(/C=C/C=C/c2ccc(C#N)cc2)cc1,CCCC#N,410.0
CN(C)c1ccc(/C=C/C=C/c2ccc(C#N)cc2)cc1,CCCCCC,400.0
CN(C)c1ccc(/C=C/C=C/c2ccc(C#N)cc2)cc1,CCOCC,400.0
CN(C)c1ccc(/C=C/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,403.0
CN(C)c1ccc(/C=C/C=C/c2ccncc2)cc1,C1COCCO1,392.0
CN(C)c1ccc(/C=C/C=C/c2ccncc2)cc1,CC#N,392.0
CN(C)c1ccc(/C=C/C=C/c2ccncc2)cc1,CCCCCCC,383.0
CN(C)c1ccc(/C=C/C=C/c2ccncc2)cc1,CO,394.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,C1COCCO1,416.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CC#N,415.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CC(C)=O,419.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CCCCCC,405.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CCCCO,424.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CCCO,423.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CCO,422.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CN(C)C=O,423.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,CO,422.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,Cc1ccccc1,419.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,ClC(Cl)(Cl)Cl,415.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,ClC(Cl)Cl,420.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,ClCCl,421.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,OCC(O)CO,432.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,OCCO,431.0
CN(C)c1ccc(/C=C/C=C/c2nc3ccccc3s2)cc1,c1ccccc1,420.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,C1CCCCC1,480.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CC#N,490.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CC(C)=O,493.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CC(C)O,515.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CCCCCC,478.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CCCCO,524.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CCCO,515.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CCO,510.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CCOC(C)=O,480.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CCOCC,475.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CN(C)C=O,507.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CO,523.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,CS(C)=O,512.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,Cc1ccccc1,495.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,ClC(Cl)(Cl)Cl,465.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,ClCCl,503.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,OCC(F)(F)F,534.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,S=C=S,480.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,c1ccccc1,475.0
CN(C)c1ccc(/C=C/C=C2\CC/C(=C\C=C\c3ccc(N(C)C)cc3)C2=O)cc1,c1ccncc1,507.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CC#N,409.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CC(C)=O,416.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CC(C)O,420.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CCCCCC,394.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CCCCO,425.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CCCO,422.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CCO,422.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CCOC(C)=O,408.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CCOCC,399.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CN(C)C=O,408.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CO,420.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,CS(C)=O,416.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,Cc1ccccc1,409.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,ClC(Cl)(Cl)Cl,407.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,ClC(Cl)Cl,404.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,ClCCl,420.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,c1ccccc1,411.0
CN(C)c1ccc(/C=C/C=C2\CCCC2=O)cc1,c1ccncc1,419.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CC#N,426.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CC(C)(C)O,420.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CC(C)=O,418.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CC(C)O,432.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CCCCO,433.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CO,434.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,CS(C)=O,438.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,ClC(Cl)Cl,433.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,ClCCl,430.0
CN(C)c1ccc(/C=C/C=N/N=C/c2ccc3ccc4cccc5ccc2c3c45)cc1,O,420.0
CN(C)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(C)C)cc3)nc(/C=C/c3ccc(C(F)(F)F)cc3)n2)cc1,ClCCl,429.0
CN(C)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(C)C)cc3)nc(/C=C/c3ccc(N(C)C)cc3)n2)cc1,ClCCl,402.0
CN(C)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(C)C)cc3)nc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClCCl,406.0
CN(C)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(C)C)cc3)nc(/C=C/c3ccccc3)n2)cc1,ClCCl,423.0
CN(C)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(C)C)cc3)nc(N)n2)cc1,Cc1ccccc1,414.0
CN(C)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(C)C)cc3)nc(N)n2)cc1,ClC(Cl)Cl,426.0
CN(C)c1ccc(/C=C/c2cc(/C=C/c3ccc(N(C)C)cc3)ncn2)cc1,ClCCl,429.0
CN(C)c1ccc(/C=C/c2cc3ccccc3c[n+]2C)cc1,CC(C)=O,425.0
CN(C)c1ccc(/C=C/c2cc3ccccc3c[n+]2C)cc1,ClCCl,441.0
CN(C)c1ccc(/C=C/c2cc[n+](C)c3ccccc23)cc1,CC(C)=O,540.0
CN(C)c1ccc(/C=C/c2cc[n+](C)c3ccccc23)cc1,ClCCl,581.0
CN(C)c1ccc(/C=C/c2cc[n+](C)c3ccccc23)cc1,O,510.0
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,C1CCOC1,483.0007873
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CC#N,469.999906
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CC(C)=O,471.0005214
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CC(C)O,476.9991032
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CC1COC(=O)O1,473.0010974
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CCO,480.000768
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CCOC(C)=O,464.0005197
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CO,475.0000381
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,CS(C)=O,471.0004993
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,ClC(Cl)Cl,500.0
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,ClCCl,522.0
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,O,448.0005734
CN(C)c1ccc(/C=C/c2cc[n+](C)cc2)cc1,c1ccncc1,494.0003656
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC#N,473.0010974
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC(C)=O,476.0000762
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC(C)O,488.0000781
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC1COC(=O)O1,474.0010428
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CCO,483.9989933
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CN(C)C=O,473.0010974
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CO,478.0000478
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CS(C)=O,476.0000762
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,ClC(Cl)Cl,490.9999705
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,O,462.000462
CN(C)c1ccc(/C=C/c2cc[n+](CCCCCCCCCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,c1ccncc1,488.9999462
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC#N,478.0000478
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC(C)=O,476.0000762
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC(C)O,486.0007484
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC1COC(=O)O1,478.0000478
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CCO,492.0000787
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CN(C)C=O,478.0000478
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CO,483.9989933
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CS(C)=O,479.0006131
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,ClC(Cl)Cl,494.0003656
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,O,457.0007952
CN(C)c1ccc(/C=C/c2cc[n+](CCCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,c1ccncc1,489.999118
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,C1COCCO1,460.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CC(C)O,479.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CCCCCCCCO,485.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CCCCO,480.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CCCO,482.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CCO,484.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CO,486.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,CS(C)=O,479.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,ClC(Cl)Cl,489.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCOCC(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)(COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)COCCC[n+]3ccc(/C=C/c4ccc(N(C)C)cc4)cc3)cc2)cc1,ClCCl,489.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCS(=O)(=O)[O-])c3ccccc23)cc1,CO,547.0
CN(C)c1ccc(/C=C/c2cc[n+](CCCS(=O)(=O)[O-])cc2)cc1,CO,480.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,C1COCCO1,480.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,CC(C)O,490.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,CCCCCCCCO,489.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,CCCCO,491.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,CCCO,495.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,CCO,498.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,CO,498.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,CS(C)=O,491.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,ClC(Cl)Cl,500.0
CN(C)c1ccc(/C=C/c2cc[n+](Cc3cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)cc(C[n+]4ccc(/C=C/c5ccc(N(C)C)cc5)cc4)c3)cc2)cc1,ClCCl,500.0
CN(C)c1ccc(/C=C/c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,C1CCOC1,375.0
CN(C)c1ccc(/C=C/c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,C1COCCO1,369.0
CN(C)c1ccc(/C=C/c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,CC#N,379.0
CN(C)c1ccc(/C=C/c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,CCO,379.0
CN(C)c1ccc(/C=C/c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,ClCCl,381.0
CN(C)c1ccc(/C=C/c2ccc(-c3ccc(/C=C/c4ccc(N(C)C)cc4)s3)s2)cc1,Cc1ccccc1,457.9335793
CN(C)c1ccc(/C=C/c2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,C1CCCCC1,376.0
CN(C)c1ccc(/C=C/c2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,CC#N,380.0
CN(C)c1ccc(/C=C/c2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,CO,378.0
CN(C)c1ccc(/C=C/c2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,ClC(Cl)Cl,383.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CC#N,334.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CC(C)=O,337.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCC,334.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCCCCO,344.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCCO,343.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCO,341.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCO,341.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CN(C)C=O,338.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CO,335.0
CN(C)c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CS(C)=O,340.0
CN(C)c1ccc(/C=C/c2ccc(C#N)cc2)cc1,C1CCOC1,385.0
CN(C)c1ccc(/C=C/c2ccc(C#N)cc2)cc1,CC#N,383.0
CN(C)c1ccc(/C=C/c2ccc(C#N)cc2)cc1,CCCC#N,386.0
CN(C)c1ccc(/C=C/c2ccc(C#N)cc2)cc1,CCCCCC,378.0
CN(C)c1ccc(/C=C/c2ccc(C#N)cc2)cc1,CCCCOCCCC,380.0
CN(C)c1ccc(/C=C/c2ccc(C#N)cc2)cc1,CCO,383.0
CN(C)c1ccc(/C=C/c2ccc(C#N)cc2)cc1,CCOCC,380.0
CN(C)c1ccc(/C=C/c2ccc3ccccc3[n+]2C)cc1,CC(C)=O,522.0
CN(C)c1ccc(/C=C/c2ccc3ccccc3[n+]2C)cc1,CO,523.0
CN(C)c1ccc(/C=C/c2ccc3ccccc3[n+]2C)cc1,ClCCl,556.0
CN(C)c1ccc(/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,381.0
CN(C)c1ccc(/C=C/c2ccccc2)cc1,CC#N,351.0
CN(C)c1ccc(/C=C/c2ccccc2)cc1,CCCCCC,347.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,C1CCCCC1,352.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,C1CCOC1,355.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,C1COCCO1,355.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CC#N,355.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CC(C)O,355.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CCCCCC,352.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CCCCCCC,352.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CCCCO,357.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CCO,357.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CCOC(C)=O,352.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CCOCC,350.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CN(C)C=O,367.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CO,362.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,CS(C)=O,370.0
CN(C)c1ccc(/C=C/c2ccccn2)cc1,O,348.0
CN(C)c1ccc(/C=C/c2cccnn2)cc1,C1CCOC1,369.0
CN(C)c1ccc(/C=C/c2cccnn2)cc1,CC#N,369.0
CN(C)c1ccc(/C=C/c2cccnn2)cc1,CS(C)=O,380.0
CN(C)c1ccc(/C=C/c2cccnn2)cc1,ClCCl,365.0
CN(C)c1ccc(/C=C/c2ccncn2)cc1,ClCCl,393.0
CN(C)c1ccc(/C=C/c2cnc(-c3ccncc3)o2)cc1,ClCCl,396.0
CN(C)c1ccc(/C=C/c2cnc(/C=C/c3ccc(C#N)cc3)o2)cc1,ClCCl,432.0
CN(C)c1ccc(/C=C/c2cnc(C#Cc3ccc(C#N)cc3)o2)cc1,ClCCl,390.0
CN(C)c1ccc(/C=C/c2cnc3ccccc3n2)cc1,C1CCOC1,424.0
CN(C)c1ccc(/C=C/c2cnc3ccccc3n2)cc1,CC#N,424.0
CN(C)c1ccc(/C=C/c2cnc3ccccc3n2)cc1,CCCCCCC,418.0
CN(C)c1ccc(/C=C/c2cnc3ccccc3n2)cc1,CS(C)=O,435.0
CN(C)c1ccc(/C=C/c2cnc3ccccc3n2)cc1,ClCCl,427.0
CN(C)c1ccc(/C=C/c2nc(/C=C/c3ccc(N(C)C)cc3)c3ccccc3n2)cc1,ClCCl,413.0
CN(C)c1ccc(/C=C/c2nc(N3CCOCC3)c3c([n+]2[O-])CCCC3)cc1,ClCCl,420.0
CN(C)c1ccc(/C=C/c2nc3c(ccc4ccccc43)s2)cc1,C1CCCCC1,402.0
CN(C)c1ccc(/C=C/c2nc3c(ccc4ccccc43)s2)cc1,CC#N,409.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,C1CCOC1,390.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,C1COCCO1,389.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,CC#N,389.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,CC1CCCCC1,386.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,CCOC(C)=O,387.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,CCOCC,386.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,CN(C)C=O,392.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,COC(C)=O,389.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,CS(C)=O,396.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,Cc1ccccc1,393.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3[nH]2)cc1,ClC(Cl)Cl,393.0
CN(C)c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3o2)cc1,CC#N,399.0
CN(C)c1ccc(/C=C/c2nc3cc(Br)ccc3nc2-c2ccccc2)cc1,C1COCCO1,445.0
CN(C)c1ccc(/C=C/c2nc3cc(Br)ccc3nc2-c2ccccc2)cc1,CC#N,448.0
CN(C)c1ccc(/C=C/c2nc3cc(Br)ccc3nc2-c2ccccc2)cc1,ClCCl,453.0
CN(C)c1ccc(/C=C/c2nc3ccc(Br)cc3nc2-c2ccccc2)cc1,C1COCCO1,445.0
CN(C)c1ccc(/C=C/c2nc3ccc(Br)cc3nc2-c2ccccc2)cc1,CC#N,448.0
CN(C)c1ccc(/C=C/c2nc3ccc(Br)cc3nc2-c2ccccc2)cc1,ClCCl,453.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,C1CCCCC1,467.5
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,C1COCCO1,478.5
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CC#N,489.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CC(C)=O,488.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CC(O)CO,502.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CCCCCCC,465.5
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CCO,494.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CCOC(C)=O,482.5
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CN(C)C=O,498.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,CS(C)=O,503.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,Cc1ccccc1,485.5
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,ClC(Cl)Cl,497.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,ClCCl,495.0
CN(C)c1ccc(/C=C/c2nc3ccc(N(C)C)cc3oc2=O)cc1,OCC(O)CO,512.5
CN(C)c1ccc(/C=C/c2nc3ccccc3o2)cc1,C1CCCCC1,380.0
CN(C)c1ccc(/C=C/c2nc3ccccc3o2)cc1,CO,390.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,C1CCCCC1,384.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,C1CCOC1,396.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,C1COCCO1,393.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CC#N,401.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CC(C)O,394.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CCCCCC,384.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CCCCCCC,387.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CCO,396.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CCOC(C)=O,391.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CCOCC,390.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CN(C)C=O,402.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CO,397.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,CS(C)=O,405.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,O,402.0
CN(C)c1ccc(/C=C/c2nc3ccccc3s2)cc1,OCC(O)CO,409.0
CN(C)c1ccc(/C=C/c2ncc3ccccc3n2)cc1,CC#N,413.0
CN(C)c1ccc(/C=C/c2ncc3ccccc3n2)cc1,ClCCl,395.0
CN(C)c1ccc(/C=C/c2ncccn2)cc1,ClCCl,379.0
CN(C)c1ccc(/C=C/c2ncnc3ccccc23)cc1,ClCCl,433.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,C1CCCCC1,456.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,C1COCCO1,466.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CC#N,473.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CC(C)=O,470.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CC(C)O,470.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CCCCCC,443.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CCCCCO,470.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CCCCO,472.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CCO,470.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CN(C)C=O,482.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,CO,473.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,ClC(Cl)(Cl)Cl,466.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,ClC(Cl)Cl,472.0
CN(C)c1ccc(/C=C2/N=C(c3ccccc3)OC2=O)cc1,ClCCl,472.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,C1CCOC1,458.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CC#N,456.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CC(C)=O,454.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CC(C)O,471.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CCCCO,473.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CCCCOC(C)=O,442.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CCCO,473.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CCO,472.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CCOC(=O)c1ccccc1,459.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CCOC(C)=O,446.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CCOCC,438.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CN(C)C=O,464.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CO,473.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,CS(C)=O,471.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,Cc1ccccc1,455.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,ClC(Cl)(Cl)Cl,446.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,ClC(Cl)Cl,469.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,ClCCl,464.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,Clc1ccccc1Cl,465.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,O=C1CCCC1,460.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,S=C=S,464.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,c1ccccc1,457.0
CN(C)c1ccc(/C=C2\CC/C(=C\c3ccc(C#N)cc3)C2=O)cc1,c1ccncc1,467.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CC#N,380.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CC(C)=O,379.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CC(C)O,390.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CCCCCC,357.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CCCCO,392.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CCCO,394.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CCO,390.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CCOC(C)=O,370.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CCOCC,365.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CN(C)C=O,383.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CO,391.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,CS(C)=O,383.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,Cc1ccccc1,373.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,ClC(Cl)(Cl)Cl,370.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,ClC(Cl)Cl,383.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,ClCCl,383.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,S=C=S,387.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,c1ccccc1,380.0
CN(C)c1ccc(/C=C2\CCCC2=O)cc1,c1ccncc1,384.0
CN(C)c1ccc(/C=c2\o/c(=C\c3ccc(C#N)cc3)c3ccccc23)cc1,ClCCl,438.0
CN(C)c1ccc(/C=c2\o/c(=C\c3ccc(C(F)(F)F)cc3)c3ccccc23)cc1,ClCCl,408.0
CN(C)c1ccc(/C=c2\o/c(=C\c3cccc(Cl)c3)c3ccccc23)cc1,ClCCl,407.0
CN(C)c1ccc(/C=c2\o/c(=C\c3ccccc3)c3cc(Cl)ccc23)cc1,ClCCl,406.0
CN(C)c1ccc(/C=c2\o/c(=C\c3ccccc3)c3ccccc23)cc1,ClCCl,404.0
CN(C)c1ccc(/C=c2\o/c(=C\c3ccccc3Cl)c3ccccc23)cc1,ClCCl,402.0
CN(C)c1ccc(C#C/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC(=N2)/C=4C#Cc2ccc(C(=O)O)cc2)cc1,C1CCOC1,672.0
CN(C)c1ccc(C#C/C2=C3\C=CC(=N3)/C(c3cc(C(C)(C)C)cc(C(C)(C)C)c3)=c3/cc4c5ccc6c7ccc8c9c(ccc(c%10ccc(c%11c4n3[Ni]n3c2ccc3/C(c2cc(C(C)(C)C)cc(C(C)(C)C)c2)=C2/C=CC%11=N2)c5c%106)c97)C(=O)OC8=O)cc1,ClC(Cl)Cl,847.0
CN(C)c1ccc(C#C/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccccc2)=C2/C=CC(=N2)/C=4C#Cc2ccc(C(=O)O)cc2)cc1,C1CCOC1,454.0
CN(C)c1ccc(C#CC2=C3CCc4ccccc4C3=[O+][B-](F)(F)O2)cc1,ClCCl,514.0
CN(C)c1ccc(C#Cc2c(F)c(F)c(C#Cc3ccc(N(C)C)cc3)c(F)c2F)cc1,ClCCl,409.0
CN(C)c1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(C(=O)O)cc3)c3ccccc23)cc1,C1CCOC1,491.0
CN(C)c1ccc(C#Cc2cc(C#Cc3ccc(C(F)(F)F)cc3)c3ccc4c(C#Cc5ccc(C(F)(F)F)cc5)cc(C#Cc5ccc(C(F)(F)F)cc5)c5ccc2c3c54)cc1,ClCCl,501.0
CN(C)c1ccc(C#Cc2cc(C#Cc3ccc(C(F)(F)F)cc3)c3ccc4c(C#Cc5ccc(C(F)(F)F)cc5)cc(C#Cc5ccc(N(C)C)cc5)c5ccc2c3c54)cc1,ClCCl,506.0
CN(C)c1ccc(C#Cc2cc(C#Cc3ccc(C(F)(F)F)cc3)c3ccc4c(C#Cc5ccc(N(C)C)cc5)cc(C#Cc5ccc(C(F)(F)F)cc5)c5ccc2c3c45)cc1,ClCCl,509.0
CN(C)c1ccc(C#Cc2cc(C#Cc3ccc(N(C)C)cc3)c3ccc4c(C#Cc5ccc(C(F)(F)F)cc5)cc(C#Cc5ccc(N(C)C)cc5)c5ccc2c3c54)cc1,ClCCl,506.0
CN(C)c1ccc(C#Cc2cc(C#Cc3ccc(N(C)C)cc3)c3ccc4c(C#Cc5ccc(N(C)C)cc5)cc(C#Cc5ccc(N(C)C)cc5)c5ccc2c3c54)cc1,ClCCl,508.0
CN(C)c1ccc(C#Cc2cc(C#Cc3ccc(N(C)C)cc3)nc(Cl)n2)cc1,ClC(Cl)Cl,434.0
CN(C)c1ccc(C#Cc2cc(C#N)c(C#Cc3cc(C#N)ccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,476.0
CN(C)c1ccc(C#Cc2cc(C#N)c(C#Cc3ccccc3)cc2C#N)cc1,ClC(Cl)Cl,449.0
CN(C)c1ccc(C#Cc2cc3c(cc2C#Cc2ccc(N(C)C)cc2)/C2=C(\c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc5n4[Zn]n4/c(cc/c4=C(\c4cc(C(C)(C)C)cc(C(C)(C)C)c4)C4=N/C(=C\5c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c5cc(/C=C/C(=O)O)c(/C=C/C(=O)O)cc54)=C(/c4cc(C(C)(C)C)cc(C(C)(C)C)c4)C3=N2)cc1,C1CCOC1,480.0
CN(C)c1ccc(C#Cc2cc3ccccc3oc2=O)cc1,ClCCl,406.0
CN(C)c1ccc(C#Cc2ccc(-c3c(F)c(F)c(-c4ccc(C#Cc5ccc(N(C)C)cc5)cc4)c(F)c3F)cc2)cc1,ClCCl,363.0
CN(C)c1ccc(C#Cc2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)cc1,CN(C)C=O,426.0
CN(C)c1ccc(C#Cc2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,C1CCCCC1,372.0
CN(C)c1ccc(C#Cc2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,CC#N,357.0
CN(C)c1ccc(C#Cc2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,CO,356.0
CN(C)c1ccc(C#Cc2ccc(-c3nc(C#N)c(C#N)n3C)cc2)cc1,ClC(Cl)Cl,369.0
CN(C)c1ccc(C#Cc2ccc(/C=C(\C#N)C(=O)O)s2)cc1,CN(C)C=O,408.0
CN(C)c1ccc(C#Cc2ccc(C#Cc3cc(C#N)ccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,421.0
CN(C)c1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,C1CCOC1,422.0
CN(C)c1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,CC#N,413.0
CN(C)c1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,CN(C)C=O,426.0
CN(C)c1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,ClC(Cl)Cl,425.0
CN(C)c1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,c1ccccc1,426.0
CN(C)c1ccc(C#Cc2ccc(C#Cc3ccccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,414.0
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,C1CCCCC1,375.3753754
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,C1CCOC1,370.9198813
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,C1COCCO1,366.0322108
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CC#N,366.1662395
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CC(C)=O,367.6470588
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CC(C)CC(C)(C)C,371.7472119
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CC(C)O,367.6470588
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CC1CCCO1,368.1885125
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CCCCCCCCCCCCCCCC,375.9963904
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CCCCCCCCCCCCCCCCCl,373.9995512
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CCOC(C)=O,366.8378577
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CCOCC,364.6973012
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CN(C)C=O,372.8560776
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CO,365.8982803
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,CS(C)=O,376.6478343
CN(C)c1ccc(C#Cc2ccc(C#N)cc2)cc1,Cc1ccccc1,372.8560776
CN(C)c1ccc(C#Cc2ccc(C3=[N+]4C(=Nc5c(-c6ccccc6)cc(-c6ccc(C#Cc7ccc(N(C)C)cc7)cc6)n5[B-]4(F)F)C(c4ccccc4)=C3)cc2)cc1,Cc1ccccc1,745.0
CN(C)c1ccc(C#Cc2ccc(C=C(C#N)C(=O)O)cc2)cc1,ClCCl,432.0
CN(C)c1ccc(C#Cc2ccc(C=C(C#N)C(=O)O)s2)cc1,ClCCl,480.0
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,C1CCCCC1,381.5046544
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,C1CCOC1,379.5066414
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,C1COCCO1,375.0093752
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CC#N,375.0093752
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CC(C)=O,388.0029488
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CC(C)CC(C)(C)C,383.494401
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CC(C)O,380.503025
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CC1CCCO1,382.0001528
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CCCCCCCCCCCCCCCC,382.9950211
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CCCCCCCCCCCCCCCCCl,390.00039
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CCOC(C)=O,375.0093752
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CCOCC,372.4949713
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CN(C)C=O,379.5066414
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CO,380.503025
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,CS(C)=O,386.996904
CN(C)c1ccc(C#Cc2ccc(C=O)cc2)cc1,Cc1ccccc1,381.5046544
CN(C)c1ccc(C#Cc2ccc3c(N(C)C)cc(-c4ccccc4)cc3c2)cc1,CC#N,342.1333333
CN(C)c1ccc(C#Cc2ccc3c(N(C)C)cc(-c4ccccc4)cc3c2)cc1,CCO,335.7333333
CN(C)c1ccc(C#Cc2ccc3c(N(C)C)cc(-c4ccccc4)cc3c2)cc1,ClCCl,341.0
CN(C)c1ccc(C#Cc2ccc3c4c(Oc5ccc(C(C)(C)CC(C)(C)C)cc5)cc5c6c(cc(Oc7ccc(C(C)(C)CC(C)(C)C)cc7)c(c7cccc2c73)c64)C(=O)OC5=O)cc1,ClCCl,568.0
CN(C)c1ccc(C#Cc2ccc3ccc(=O)oc3c2)cc1,CC#N,333.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,C1COCCO1,430.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,CC(C)=O,447.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,CCCCCC,439.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,CCCCCCO,430.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,CCO,431.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,CCOC(C)=O,431.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,CO,436.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,Cc1ccccc1,433.0
CN(C)c1ccc(C#Cc2ccc3ccc4c(C#Cc5ccc(N(C)C)cc5)ccc5ccc2c3c54)cc1,ClCCl,439.0
CN(C)c1ccc(C#Cc2ccccc2)cc1,C1CCCCC1,316.8969451
CN(C)c1ccc(C#Cc2ccccc2)cc1,C1CCOC1,328.7959492
CN(C)c1ccc(C#Cc2ccccc2)cc1,C1COCCO1,326.6052649
CN(C)c1ccc(C#Cc2ccccc2)cc1,CC(C)=O,329.4024639
CN(C)c1ccc(C#Cc2ccccc2)cc1,CC(C)CC(C)(C)C,315.000315
CN(C)c1ccc(C#Cc2ccccc2)cc1,CC(C)O,321.3987273
CN(C)c1ccc(C#Cc2ccccc2)cc1,CC1CCCO1,327.0966898
CN(C)c1ccc(C#Cc2ccccc2)cc1,CCCCCCCCCCCCCCCC,316.8969451
CN(C)c1ccc(C#Cc2ccccc2)cc1,CCCCCCCCCCCCCCCCCl,330.00033
CN(C)c1ccc(C#Cc2ccccc2)cc1,CO,324.0020736
CN(C)c1ccc(C#Cc2ccccc2)cc1,Cc1ccccc1,326.2962117
CN(C)c1ccc(C#Cc2nc(-c3ccccc3)nc3ccccc23)cc1,ClCCl,414.0
CN(C)c1ccc(C(=C(C#N)C#N)C(=C(C#N)C#N)c2ccc(C(=O)O)cc2)cc1,ClCCl,468.0
CN(C)c1ccc(C(=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)c2ccc(C(=O)O)cc2)cc1,CO,490.0
CN(C)c1ccc(C(=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)c2ccc(C=C(C#N)C(=O)O)cc2)cc1,CO,503.0
CN(C)c1ccc(C(=C2C=C(C(C)(C)C)OC(C(C)(C)C)=C2)c2ccc(C=C(C#N)C(=O)O)s2)s1,ClCCl,562.0
CN(C)c1ccc(C(=Cc2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(/C=C6\SC(=S)N(CC(=O)O)C6=O)cc5)cc4)s3)cc2)c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,478.0
CN(C)c1ccc(C(=Cc2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccc(C=C(C#N)C(=O)O)cc5)cc4)s3)cc2)c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,432.0
CN(C)c1ccc(C(=Cc2ccc(-c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)cc3)cc2)c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,444.0
CN(C)c1ccc(C(=Cc2ccc(-c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)s2)c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,496.0
CN(C)c1ccc(C(=Cc2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4)cc3)cc2)c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,463.0
CN(C)c1ccc(C(=Cc2ccc(-c3ccc(N(c4ccccc4)c4ccc(C=C(C#N)C(=O)O)cc4)cc3)cc2)c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,432.0
CN(C)c1ccc(C(=Cc2ccc(/C=C(\C#N)c3ccccc3)cc2)c2ccc(N(C)C)cc2)cc1,C1CCOC1,436.0
CN(C)c1ccc(C(=Cc2ccc(/C=C/c3ccc(C#N)cc3)cc2)c2ccc(N(C)C)cc2)cc1,C1CCOC1,415.0
CN(C)c1ccc(C(=Cc2ccc(C#N)cc2)c2ccc(N(C)C)cc2)cc1,C1CCOC1,364.0
CN(C)c1ccc(C(=Cc2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)cc2)c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,500.0
CN(C)c1ccc(C(=Cc2ccc(C=O)cc2)c2ccc(N(C)C)cc2)cc1,C1CCOC1,407.0
CN(C)c1ccc(C(=O)Nc2ccc(Cl)cc2)cc1,C1CCCCC1,309.0
CN(C)c1ccc(C(=O)Nc2ccc(Cl)cc2)cc1,C1CCOC1,315.0
CN(C)c1ccc(C(=O)Nc2ccc(Cl)cc2)cc1,CC#N,317.0
CN(C)c1ccc(C(=O)Nc2ccc(Cl)cc2)cc1,CCOCC,310.0
CN(C)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1,C1CCCCC1,337.0
CN(C)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1,C1CCOC1,353.0
CN(C)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1,CC#N,354.0
CN(C)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1,CCOCC,345.0
CN(C)c1ccc(C(=O)c2ccccc2)cc1,C1CCCCC1,325.0
CN(C)c1ccc(C(=O)c2ccccc2)cc1,CC#N,345.0
CN(C)c1ccc(C(=O)c2ccccc2)cc1,CO,355.0
CN(C)c1ccc(C(=O)c2ccccc2)cc1,CS(C)=O,350.0
CN(C)c1ccc(C(=O)c2ccccc2)cc1,c1ccccc1,340.0
CN(C)c1ccc(C(C=C(C#N)C#N)=C(C#N)C#N)cc1,ClCCl,570.0
CN(C)c1ccc(C2=C(C#N)C(NCCN)=NC23C(C#N)=C(N)Oc2ccccc23)cc1,C1CCOC1,403.0
CN(C)c1ccc(C2=C(C#N)C(NCCN)=NC23C(C#N)=C(N)Oc2ccccc23)cc1,CS(C)=O,415.0
CN(C)c1ccc(C2=C(C#N)C(NCCO)=NC23C(C#N)=C(N)Oc2ccccc23)cc1,C1CCOC1,405.0
CN(C)c1ccc(C2=C(C#N)C(NCCO)=NC23C(C#N)=C(N)Oc2ccccc23)cc1,CS(C)=O,414.0
CN(C)c1ccc(C2=C(c3ccccc3)c3oc4ccccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,414.0
CN(C)c1ccc(C2=C(c3ccccc3)c3sc4ccccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,446.0
CN(C)c1ccc(C2=C3C(=O)NC(c4ccc(N(C)C)cc4)=C3C(=O)N2)cc1,CS(C)=O,562.0
CN(C)c1ccc(C2=C3C(=O)NC(c4ccccc4)=C3C(=O)N2)cc1,CS(C)=O,544.0
CN(C)c1ccc(C2=C3C=C(c4ccc(C#N)cc4)S[C@]34c3ccccc3[C@H]2c2ccccc24)cc1,ClCCl,451.0
CN(C)c1ccc(C2=C3C=C(c4ccc(C=O)cc4)S[C@]34c3ccccc3[C@H]2c2ccccc24)cc1,ClCCl,464.0
CN(C)c1ccc(C2=CC3=C(c4ccc(C#N)cc4)[C@H]4c5ccccc5[C@]3(S2)c2ccccc24)cc1,ClCCl,436.0
CN(C)c1ccc(C2=CC3=C(c4ccc(C=C(C#N)C#N)cc4)[C@H]4c5ccccc5[C@]3(S2)c2ccccc24)cc1,ClCCl,543.0
CN(C)c1ccc(C2=CC3=C(c4ccc(C=O)cc4)[C@H]4c5ccccc5[C@]3(S2)c2ccccc24)cc1,ClCCl,449.0
CN(C)c1ccc(C2=CC3=C(c4ccc([N+](=O)[O-])cc4)[C@H]4c5ccccc5[C@]3(S2)c2ccccc24)cc1,ClCCl,484.0
CN(C)c1ccc(C2=CC=C(C(=O)O)CC2)cc1,C1CCOC1,385.0
CN(C)c1ccc(C2=CC=C(C(=O)O)CC2)cc1,CC#N,391.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,478.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,C1COCCO1,477.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,CC#N,476.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,CC1CCCCC1,474.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,CCOC(C)=O,475.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,CCOCC,472.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,CN(C)C=O,484.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,CO,475.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,COC(C)=O,477.0
CN(C)c1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,483.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,C1CCOC1,462.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,C1COCCO1,463.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,CC#N,458.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,CC1CCCCC1,462.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,CCOC(C)=O,458.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,CCOCC,458.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,CN(C)C=O,464.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,CO,458.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,COC(C)=O,460.0
CN(C)c1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,466.0
CN(C)c1ccc(C2=Cc3cc(Cl)nc[n+]3[B-](F)(F)O2)cc1,C1CCOC1,451.0
CN(C)c1ccc(C2=Cc3cc(Cl)nc[n+]3[B-](F)(F)O2)cc1,CC#N,452.0
CN(C)c1ccc(C2=Cc3cc(Cl)nc[n+]3[B-](F)(F)O2)cc1,CCCCCC,444.0
CN(C)c1ccc(C2=Cc3cc(Cl)nc[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,453.0
CN(C)c1ccc(C2=Cc3cc(Cl)nc[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,460.0
CN(C)c1ccc(C2=Cc3cc(Cl)nc[n+]3[B-](F)(F)O2)cc1,ClCCl,459.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,C1CCOC1,420.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,C1COCCO1,417.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,CC#N,417.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,CC1CCCCC1,413.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,CCOC(C)=O,416.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,CCOCC,413.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,CN(C)C=O,423.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,CO,418.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,COC(C)=O,417.0
CN(C)c1ccc(C2=Cc3cccc[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,426.0
CN(C)c1ccc(C2=Nc3ccc4c(C(F)(F)F)cc(C(F)(F)F)nc4[n+]3[B-](F)(F)O2)cc1,ClCCl,480.0
CN(C)c1ccc(C2=Nc3sc4c(F)c(F)c(F)c(F)c4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,434.0
CN(C)c1ccc(C2=Nc3sc4c(F)c(F)c(F)c(F)c4[n+]3[B-](F)(F)O2)cc1,CC#N,431.0
CN(C)c1ccc(C2=Nc3sc4c(F)c(F)c(F)c(F)c4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,431.0
CN(C)c1ccc(C2=Nc3sc4c(F)c(F)c(F)c(F)c4[n+]3[B-](F)(F)O2)cc1,ClCCl,433.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C#N)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,431.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C#N)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,432.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C#N)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,432.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C#N)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,434.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C#N)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,436.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C(F)(F)F)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C(F)(F)F)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C(F)(F)F)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C(F)(F)F)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,431.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(C(F)(F)F)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,434.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(N(C)C)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,433.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(N(C)C)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,435.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(N(C)C)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,436.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(N(C)C)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccc(N(C)C)cc5)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,438.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccccc5)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccccc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccccc5)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccccc5)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,430.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5ccccc5)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,432.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5cccs5)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,436.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5cccs5)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,435.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5cccs5)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,435.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5cccs5)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,436.0
CN(C)c1ccc(C2=Nc3sc4cc(-c5cccs5)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,439.0
CN(C)c1ccc(C2=Nc3sc4cc(Br)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,426.0
CN(C)c1ccc(C2=Nc3sc4cc(Br)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,430.0
CN(C)c1ccc(C2=Nc3sc4cc(Br)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,427.0
CN(C)c1ccc(C2=Nc3sc4cc(Br)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,427.0
CN(C)c1ccc(C2=Nc3sc4cc(Br)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,431.0
CN(C)c1ccc(C2=Nc3sc4cc(C(F)(F)F)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,430.0
CN(C)c1ccc(C2=Nc3sc4cc(C(F)(F)F)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,427.0
CN(C)c1ccc(C2=Nc3sc4cc(C(F)(F)F)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,431.0
CN(C)c1ccc(C2=Nc3sc4cc(C(F)(F)F)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,428.0
CN(C)c1ccc(C2=Nc3sc4cc(C(F)(F)F)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,431.0
CN(C)c1ccc(C2=Nc3sc4cc(F)ccc4[n+]3[B-](F)(F)O2)cc1,C1CCOC1,425.0
CN(C)c1ccc(C2=Nc3sc4cc(F)ccc4[n+]3[B-](F)(F)O2)cc1,CC#N,422.0
CN(C)c1ccc(C2=Nc3sc4cc(F)ccc4[n+]3[B-](F)(F)O2)cc1,CC(C)=O,426.0
CN(C)c1ccc(C2=Nc3sc4cc(F)ccc4[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,423.0
CN(C)c1ccc(C2=Nc3sc4cc(F)ccc4[n+]3[B-](F)(F)O2)cc1,ClCCl,425.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(C#N)cc4)[n+]3[B-](F)(F)O2)cc1,C1CCOC1,411.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(C#N)cc4)[n+]3[B-](F)(F)O2)cc1,CC#N,411.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(C#N)cc4)[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,414.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(C#N)cc4)[n+]3[B-](F)(F)O2)cc1,ClCCl,415.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(N(C)C)cc4)[n+]3[B-](F)(F)O2)cc1,C1CCOC1,406.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(N(C)C)cc4)[n+]3[B-](F)(F)O2)cc1,CC#N,409.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(N(C)C)cc4)[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,405.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc(N(C)C)cc4)[n+]3[B-](F)(F)O2)cc1,ClCCl,411.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc([N+](=O)[O-])cc4)[n+]3[B-](F)(F)O2)cc1,C1CCOC1,412.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc([N+](=O)[O-])cc4)[n+]3[B-](F)(F)O2)cc1,CC#N,411.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc([N+](=O)[O-])cc4)[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,415.0
CN(C)c1ccc(C2=Nc3scc(-c4ccc([N+](=O)[O-])cc4)[n+]3[B-](F)(F)O2)cc1,ClCCl,417.0
CN(C)c1ccc(C2=Nc3scc(-c4ccccc4)[n+]3[B-](F)(F)O2)cc1,C1CCOC1,406.0
CN(C)c1ccc(C2=Nc3scc(-c4ccccc4)[n+]3[B-](F)(F)O2)cc1,CC#N,406.0
CN(C)c1ccc(C2=Nc3scc(-c4ccccc4)[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,409.0
CN(C)c1ccc(C2=Nc3scc(-c4ccccc4)[n+]3[B-](F)(F)O2)cc1,ClCCl,411.0
CN(C)c1ccc(C2=Nc3scc[n+]3[B-](F)(F)O2)cc1,C1CCOC1,402.0
CN(C)c1ccc(C2=Nc3scc[n+]3[B-](F)(F)O2)cc1,CC#N,402.0
CN(C)c1ccc(C2=Nc3scc[n+]3[B-](F)(F)O2)cc1,Cc1ccccc1,405.0
CN(C)c1ccc(C2=Nc3scc[n+]3[B-](F)(F)O2)cc1,ClCCl,407.0
CN(C)c1ccc(C2=[N+]3C(=Nc4c(-c5ccc(O)cc5)cc(-c5ccc(N(C)C)cc5)n4[B-]3(F)F)C(c3ccc(O)cc3)=C2)cc1,C1CCOC1,775.0
CN(C)c1ccc(C2=[N+]3C(=Nc4c(-c5ccc(O)cc5)cc(-c5ccc(N(C)C)cc5)n4[B-]3(F)F)C(c3ccc(O)cc3)=C2)cc1,CS(C)=O,794.0
CN(C)c1ccc(C2=[N+]3C(=Nc4c(-c5ccc(O)cc5)cc(-c5ccc(N(C)C)cc5)n4[B-]3(F)F)C(c3ccc(O)cc3)=C2)cc1,Cc1ccccc1,778.0
CN(C)c1ccc(C2=[N+]3C(=Nc4c(-c5ccc(OCCCCS(=O)(=O)[O-])cc5)cc(-c5ccc(N(C)C)cc5)n4[B-]3(F)F)C(c3ccc(OCCCCS(=O)(=O)[O-])cc3)=C2)cc1,CS(C)=O,786.0
CN(C)c1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)cc(-c5ccc(N(C)C)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2)cc1,ClC(Cl)Cl,799.0
CN(C)c1ccc(C2=[N+]3C(=Nc4c5ccccc5c(-c5ccc(N(C)C)cc5)n4[B-]3(F)F)c3ccccc32)cc1,ClCCl,794.0
CN(C)c1ccc(C=C(C#N)c2ccc(F)cc2)cc1,ClCCl,393.0
CN(C)c1ccc(C=C/C=C/C=C/c2ccc(C#N)cc2)cc1,C1CCOC1,420.0
CN(C)c1ccc(C=C/C=C/C=C/c2ccc(C#N)cc2)cc1,CC#N,418.0
CN(C)c1ccc(C=C/C=C/C=C/c2ccc(C#N)cc2)cc1,CCCC#N,422.0
CN(C)c1ccc(C=C/C=C/C=C/c2ccc(C#N)cc2)cc1,CCCCCC,412.0
CN(C)c1ccc(C=C/C=C/C=C/c2ccc(C#N)cc2)cc1,CCCCOCCCC,416.0
CN(C)c1ccc(C=C/C=C/C=C/c2ccc(C#N)cc2)cc1,CCO,418.0
CN(C)c1ccc(C=C/C=C/C=C/c2ccc(C#N)cc2)cc1,CCOCC,416.0
CN(C)c1ccc(C=C2CCC(=Cc3ccc(N(C)C)cc3)C2=C(C#N)C#N)cc1,ClC(Cl)Cl,557.0
CN(C)c1ccc(C=C2Oc3cccc(O)c3C2=O)cc1,CC#N,449.0
CN(C)c1ccc(C=CC(=O)c2ccccc2)cc1,CC#N,415.0
CN(C)c1ccc(C=CC(=O)c2ccccc2)cc1,CCOC(C)=O,399.0
CN(C)c1ccc(C=CC(=O)c2ccccc2)cc1,Cc1ccccc1,393.0
CN(C)c1ccc(C=CC2=C/C(=C(/C#N)C(=O)O)C=C(C(C)(C)C)O2)cc1,ClCCl,446.0
CN(C)c1ccc(C=CC2=CC(=C(C#N)C#N)C=C(C=Cc3ccc(N(C)C)cc3)O2)cc1,ClC(Cl)Cl,483.5
CN(C)c1ccc(C=CC2=CC(=C(C#N)C(=O)O)C=C(C=Cc3ccc(N(C)C)cc3)O2)cc1,ClCCl,459.0
CN(C)c1ccc(C=CC=C2N=C(c3ccccc3)OC2=O)cc1,C1CCOC1,488.0
CN(C)c1ccc(C=CC=CC(O)=C2C(=O)c3ccccc3C2=O)cc1,CC#N,520.0
CN(C)c1ccc(C=Cc2c(F)c(F)c(C=Cc3ccc(N(C)C)cc3)c(F)c2F)cc1,ClCCl,408.0
CN(C)c1ccc(C=Cc2cc(-c3ccccc3)c(C=CC3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc2-c2ccccc2)cc1,CN(C)C=O,473.5
CN(C)c1ccc(C=Cc2cc(-c3ccccc3)c(C=CC3=CC(=C(C#N)C#N)CC(C)(C)C3)cc2-c2ccccc2)cc1,CN(C)C=O,460.0
CN(C)c1ccc(C=Cc2cc(C=Cc3ccc(N(C)C)cc3)nc(C#Cc3ccc(N(c4ccc(C#Cc5nc(C=Cc6ccc(N(C)C)cc6)cc(C=Cc6ccc(N(C)C)cc6)n5)cc4)c4ccc(C#Cc5nc(C=Cc6ccc(N(C)C)cc6)cc(C=Cc6ccc(N(C)C)cc6)n5)cc4)cc3)n2)cc1,ClCCl,408.0
CN(C)c1ccc(C=Cc2ccc(C#N)cc2)cc1,CC#N,386.0
CN(C)c1ccc(C=Cc2ccc([N+](=O)[O-])c(O)c2)cc1,C1CCCCC1,462.0
CN(C)c1ccc(C=Cc2ccc([N+](=O)[O-])cc2)cc1,Cc1ccccc1,432.0
CN(C)c1ccc(C=Cc2ccn3cc(-c4ccccc4)nc3c2)cc1,Cc1ccccc1,554.0
CN(C)c1ccc(C=Cc2ccn3cc(-c4ccccc4-c4ccc(Br)cc4)nc3c2)cc1,Cc1ccccc1,415.0
CN(C)c1ccc(C=Cc2ccn3cc(-c4ccccc4-c4ccc(Cl)cc4)nc3c2)cc1,Cc1ccccc1,430.0
CN(C)c1ccc(N(C)C)cc1,C1CCCCC1,326.2642741
CN(C)c1ccc(N2c3c(sc4ccccc34)Sc3sc4ccccc4c32)cc1,ClCCl,309.0
CN(C)c1ccc(N2c3sc4ccccc4c3Sc3c2sc2ccccc32)cc1,ClCCl,430.0
CN(C)c1ccc(N2c3sc4ccccc4c3Sc3sc4ccccc4c32)cc1,ClCCl,319.0
CN(C)c1ccc(N=Nc2ccc(C(=O)ON3C(=O)CCC3=O)cc2)cc1,CO,454.0
CN(C)c1ccc2c(-c3c(Cl)c(Cl)c(Cl)c(Cl)c3C(=O)O)c3ccc4cc(=O)ccc4c3oc2c1,O,605.0
CN(C)c1ccc2c(-c3c(F)c(F)c(F)c(F)c3C(=O)O)c3ccc4cc(=O)ccc4c3oc2c1,O,603.0
CN(C)c1ccc2c(-c3cc(C(=O)O)ccc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CO,540.0
CN(C)c1ccc2c(-c3cc(C(=O)[O-])ccc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CCO,538.0
CN(C)c1ccc2c(-c3cc(C(=O)[O-])ccc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,O,549.0
CN(C)c1ccc2c(-c3cc(N)ccc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CCO,542.0
CN(C)c1ccc2c(-c3cc(N)ccc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,O,544.0
CN(C)c1ccc2c(-c3cc(N=C=S)ccc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CO,541.0
CN(C)c1ccc2c(-c3cc4ccccc4c4ccccc34)c3ccc(=[NH2+])cc-3oc2c1,O,545.0
CN(C)c1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,485.0
CN(C)c1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,505.0
CN(C)c1ccc2c(-c3ccc(C(=O)O)cc3C(=O)O)c3ccc4cc(=O)ccc4c3oc2c1,O,576.0
CN(C)c1ccc2c(-c3ccc(C(=O)ON4C(=O)C=CC4=O)cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CO,546.0
CN(C)c1ccc2c(-c3ccc(C(=O)[O-])cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CCO,540.0
CN(C)c1ccc2c(-c3ccc(C(=O)[O-])cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,O,548.0
CN(C)c1ccc2c(-c3ccc(C(C)(C)C)cc3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,480.0
CN(C)c1ccc2c(-c3ccc(C(C)(C)C)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CN(C)c1ccc2c(-c3ccc(C4OCCCO4)cc3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,490.0
CN(C)c1ccc2c(-c3ccc(C4OCCCO4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,535.0
CN(C)c1ccc2c(-c3ccc(CN4CCC5(CC4)OCCO5)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CN(C)c1ccc2c(-c3ccc(CN4CCCCC4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CN(C)c1ccc2c(-c3ccc(F)c(Cl)c3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,495.0
CN(C)c1ccc2c(-c3ccc(F)c(Cl)c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CN(C)c1ccc2c(-c3ccc(F)cc3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,490.0
CN(C)c1ccc2c(-c3ccc(N)cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CCO,533.0
CN(C)c1ccc2c(-c3ccc(N)cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,O,544.0
CN(C)c1ccc2c(-c3ccc(N4C(=O)C=CC4=O)cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CO,541.0
CN(C)c1ccc2c(-c3ccc(N=C=S)cc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CO,543.0
CN(C)c1ccc2c(-c3ccc(Oc4ccccc4)cc3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,480.0
CN(C)c1ccc2c(-c3ccc(Oc4ccccc4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CN(C)c1ccc2c(-c3ccc4c(c3)OCO4)c3ccc(=[NH2+])cc-3n(C)c2c1,O,485.0
CN(C)c1ccc2c(-c3ccc4c(c3)OCO4)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CN(C)c1ccc2c(-c3ccc4ccccc4c3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,485.0
CN(C)c1ccc2c(-c3ccc4ccccc4c3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CN(C)c1ccc2c(-c3cccc(CN4CCCCC4)c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CN(C)c1ccc2c(-c3cccc(Cl)c3)c3ccc(=[NH2+])cc-3n(C)c2c1,O,485.0
CN(C)c1ccc2c(-c3cccc(Cl)c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CN(C)c1ccc2c(-c3cccc(F)c3)c3ccc(=[NH2+])cc-3oc2c1,O,530.0
CN(C)c1ccc2c(-c3ccccc3)c3ccc(=[N+](C)C)cc-3[se]c2c1,CO,582.0
CN(C)c1ccc2c(-c3ccccc3)c3ccc(=[N+](C)C)cc-3sc2c1,CO,571.0
CN(C)c1ccc2c(-c3ccccc3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
CN(C)c1ccc2c(-c3ccccc3C(=O)O)c3ccc4cc(=O)ccc4c3oc2c1,O,573.0
CN(C)c1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(N)cc1C3,O,557.0
CN(C)c1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,O,548.0
CN(C)c1ccc2c(-c3ccccc3S(=O)(=O)[O-])c3ccc(=[N+](C)C)cc-3oc2c1,CO,550.0
CN(C)c1ccc2c(-c3cccs3)c3ccc(=[NH2+])cc-3oc2c1,O,545.0
CN(C)c1ccc2c(C(=O)NCc3ccccc3)cc(C(=O)[O-])nc2c1,CCO,403.0
CN(C)c1ccc2c(CC(=O)O)cc(=O)oc2c1,CO,370.0
CN(C)c1ccc2c(CC(=O)ON3C(=O)C=CC3=O)cc(=O)oc2c1,CO,376.0
CN(C)c1ccc2c(c1)-c1ccccc1C2=O,C1CCCCC1,400.0
CN(C)c1ccc2c(c1)-c1ccccc1C2=O,CC#N,431.0
CN(C)c1ccc2c(c1)-c1ccccc1C2=O,CCO,437.0
CN(C)c1ccc2c(c1)-c1ccccc1C2=O,c1ccccc1,420.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,C1CCOC1,377.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,C1COCCO1,378.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,CC#N,388.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,CC(C)(C)O,387.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,CC(C)=O,382.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,CC(C)O,389.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,CCOCC,371.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,CO,396.0
CN(C)c1ccc2c(c1)C(=O)NC2=O,O,408.0
CN(C)c1ccc2c(c1)C(=O)c1ccccc1-2,C1CCCCC1,484.0
CN(C)c1ccc2c(c1)C(=O)c1ccccc1-2,CC#N,510.0
CN(C)c1ccc2c(c1)C(=O)c1ccccc1-2,CCO,509.0
CN(C)c1ccc2c(c1)C(=O)c1ccccc1-2,c1ccccc1,507.0
CN(C)c1ccc2c(c1)C(C)(C)C(=O)C=C2,O,413.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2,CCO,606.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2,CO,605.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2,O,604.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2C#Cc1ccccc1,CO,677.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2C#Cc1ccccc1,O,680.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2CCCCCCNC(=O)OC(C)(C)C,O,459.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)[O-],CCO,642.0
CN(C)c1ccc2c(c1)C(C)(C)C1=CC(=[N+](C)C)C=CC1=C2c1ccccc1C(=O)[O-],CCO,612.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc4nsnc4c3)ccc1-2,C1COCCO1,409.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc4nsnc4c3)ccc1-2,CC#N,404.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc4nsnc4c3)ccc1-2,CCO,407.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc4nsnc4c3)ccc1-2,CS(C)=O,420.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc4nsnc4c3)ccc1-2,Cc1ccccc1,413.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc4nsnc4c3)ccc1-2,ClC(Cl)Cl,414.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(-c3ccc4nsnc4c3)ccc1-2,O,446.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,C1COCCO1,394.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,CC#N,395.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,CCO,403.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,CCOC(C)=O,393.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,CO,395.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,CS(C)=O,405.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,Cc1ccccc1,391.0
CN(C)c1ccc2c(c1)C(C)(C)c1cc(C(=O)c3cn(C4CC(O)C(CO)O4)nn3)ccc1-2,ClC(Cl)Cl,403.0
CN(C)c1ccc2c(c1)CCc1cc(C=O)ccc1-2,C1CCOC1,387.0
CN(C)c1ccc2c(c1)CCc1cc(C=O)ccc1-2,CC#N,387.0
CN(C)c1ccc2c(c1)CCc1cc(C=O)ccc1-2,CCCCCC,387.0
CN(C)c1ccc2c(c1)CCc1cc(C=O)ccc1-2,CN(C)C=O,387.0
CN(C)c1ccc2c(c1)CCc1cc(C=O)ccc1-2,CO,387.0
CN(C)c1ccc2c(c1)CCc1cc(C=O)ccc1-2,Cc1ccccc1,387.0
CN(C)c1ccc2c(c1)CCc1cc(C=O)ccc1-2,ClCCl,387.0
CN(C)c1ccc2c(c1)COc1c-2oc2ccccc2c1=O,C1CCCCC1,370.0
CN(C)c1ccc2c(c1)COc1c-2oc2ccccc2c1=O,CC#N,396.0
CN(C)c1ccc2c(c1)COc1c-2oc2ccccc2c1=O,CCOC(C)=O,388.0
CN(C)c1ccc2c(c1)COc1c-2oc2ccccc2c1=O,Cc1ccccc1,385.0
CN(C)c1ccc2c(c1)Cc1c-2[o+]c2c3c4c(cc2c1-c1ccccc1C(=O)[O-])CCCN4CCC3,O,600.0
CN(C)c1ccc2c(c1)Cc1ccccc1-2,C1CCOC1,310.0
CN(C)c1ccc2c(c1)Cc1ccccc1-2,C1COCCO1,310.0
CN(C)c1ccc2c(c1)Cc1ccccc1-2,CC(=O)N(C)C,312.0
CN(C)c1ccc2c(c1)Cc1ccccc1-2,CCCCCC,303.0
CN(C)c1ccc2c(c1)Cc1ccccc1-2,CCOC(C)=O,307.0
CN(C)c1ccc2c(c1)Cc1ccccc1-2,CCOCC,305.0
CN(C)c1ccc2c(c1)Cc1ccccc1-2,CS(C)=O,316.0
CN(C)c1ccc2c(c1)OC(c1ccccc1)=C/C2=C/c1cc(-c2ccccc2)[o+]c2cc(N(C)C)ccc12,ClCCl,650.0
CN(C)c1ccc2c(c1)OC(c1ccccc1)=C/C2=C\C=C1/CCCC(/C=C/c2cc(-c3ccccc3)[o+]c3cc(N(C)C)ccc23)=C1Cl,ClCCl,1026.0
CN(C)c1ccc2c(c1)OC(c1ccccc1)=C/C2=C\C=C\C=C\c1cc(-c2ccccc2)[o+]c2cc(N(C)C)ccc12,ClCCl,862.0
CN(C)c1ccc2c(c1)OC(c1ccccc1)=C/C2=C\C=C\c1cc(-c2ccccc2)[o+]c2cc(N(C)C)ccc12,ClCCl,746.0
CN(C)c1ccc2c(c1)Oc1c(ccc3cc(O)ccc13)C21OC(=O)c2cc(C(=O)O)ccc21,O,549.0
CN(C)c1ccc2c(c1)P(=O)(c1ccccc1)C1=CC(=[N+](C)C)C=CC1=C2c1ccccc1,O,698.0
CN(C)c1ccc2c(c1)P(=O)(c1ccccc1)C1=CC(=[N+](C)C)C=CC1=C2c1ccccc1C(F)(F)F,O,709.0
CN(C)c1ccc2c(c1)P(=O)(c1ccccc1)C1=CC(=[N+]3CCCC3)C=CC1=C2c1ccccc1C(F)(F)F,O,713.0
CN(C)c1ccc2c(c1)S(=O)(=O)C1=CC(=[N+](C)C)C=CC1=C2c1ccccc1,O,703.0
CN(C)c1ccc2c(c1)[Ge](C)(C)C1=CC(=[N+](C)C)C=CC1=C2,O,621.0
CN(C)c1ccc2c(c1)[Ge](C)(C)C1=CC(=[N+](C)C)C=CC1=C2CCCCCCNC(=O)OC(C)(C)C,O,454.0
CN(C)c1ccc2c(c1)[Si](C)(C)C1=CC(=[N+](C)C)C=CC1=C2,CO,636.0
CN(C)c1ccc2c(c1)[Si](C)(C)C1=CC(=[N+](C)C)C=CC1=C2,O,634.0
CN(C)c1ccc2c(c1)[Si](C)(C)C1=CC(=[N+](C)C)C=CC1=C2C#Cc1ccccc1,CO,712.0
CN(C)c1ccc2c(c1)[Si](C)(C)C1=CC(=[N+](C)C)C=CC1=C2C#Cc1ccccc1,O,712.0
CN(C)c1ccc2c(c1)[Si](C)(C)C1=CC(=[N+](C)C)C=CC1=C2CCCCCCNC(=O)OC(C)(C)C,O,458.0
CN(C)c1ccc2c(c1)[Sn](C)(C)C1=CC(=[N+](C)C)C=CC1=C2,O,614.0
CN(C)c1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3ccccc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,507.0
CN(C)c1ccc2c(c1)c1cccc3cnc2n31,CO,469.0
CN(C)c1ccc2c(ccc3c(-c4ccccc4C(=O)[O-])c4ccc(=[NH2+])cc-4oc32)c1,O,568.0
CN(C)c1ccc2c3c(c(=O)oc2c1)C=c1cc2c(cc1O3)=[N+](CCC(=O)O)CCC2,CC#N,593.0
CN(C)c1ccc2c3c(c(=O)oc2c1)C=c1cc2c(cc1O3)=[N+](CCC(=O)O)CCC2,CO,591.0
CN(C)c1ccc2c3c(c(=O)oc2c1)C=c1cc2c(cc1O3)=[N+](CCC(=O)O)CCC2,ClCCl,606.0
CN(C)c1ccc2c3c(c(=O)oc2c1)C=c1cc2c(cc1O3)=[N+](CCC(=O)O)CCC2,O,587.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,C1CCCCC1,347.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,CC#N,356.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,CC(C)O,368.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,CCC(C)=O,356.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,CCO,369.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,CCOC(C)=O,353.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,CS(C)=O,363.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,Cc1ccccc1,353.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,ClCCl,358.0
CN(C)c1ccc2c3c(ccc2c1)C(=O)CCC3,Clc1ccccc1,357.0
CN(C)c1ccc2c3c(oc2c1)-c1ccccc1C(C)(C)C3=O,CC#N,538.0
CN(C)c1ccc2c3c(oc2c1)-c1ccccc1C(Cc1ccccc1)(Cc1ccccc1)C3=O,CC#N,546.0
CN(C)c1ccc2c3ccc4c5c(ccc(c6cccc1c62)c53)C(=O)OC4=O,CC#N,556.0
CN(C)c1ccc2c3ccc4c5c(ccc(c6cccc1c62)c53)C(=O)OC4=O,CS(C)=O,561.0
CN(C)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,C1CCOC1,335.0
CN(C)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CC#N,336.0
CN(C)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CC(C)O,333.0
CN(C)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CCO,334.0
CN(C)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CCOC(C)=O,333.0
CN(C)c1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CO,336.0
CN(C)c1ccc2cc(C(/C=C/c3c[nH]c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,C1CCOC1,447.0
CN(C)c1ccc2cc(C(/C=C/c3c[nH]c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,C1COCCO1,444.0
CN(C)c1ccc2cc(C(/C=C/c3c[nH]c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,CN(C)C=O,466.0
CN(C)c1ccc2cc(C(/C=C/c3c[nH]c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,CS(C)=O,470.0
CN(C)c1ccc2cc(C(/C=C/c3c[nH]c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,ClCCl,446.0
CN(C)c1ccc2cc(C(/C=C/c3cn(C)c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,C1CCOC1,455.0
CN(C)c1ccc2cc(C(/C=C/c3cn(C)c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,C1COCCO1,452.0
CN(C)c1ccc2cc(C(/C=C/c3cn(C)c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,CN(C)C=O,471.0
CN(C)c1ccc2cc(C(/C=C/c3cn(C)c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,CS(C)=O,477.0
CN(C)c1ccc2cc(C(/C=C/c3cn(C)c4ccccc34)=C(C#N)C#N)c(=O)oc2c1,ClCCl,461.0
CN(C)c1ccc2cc(C(=O)CBr)ccc2c1,CO,387.0
CN(C)c1ccc2cc(C(=O)NCCN3C(=O)C=CC3=O)c(=O)oc2c1,CO,419.0
CN(C)c1ccc2cc(C(=O)NCCNC(=O)CI)c(=O)oc2c1,CO,420.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccc(C#N)cc4)=C3)ccc2c1,C1CCOC1,525.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccc(C#N)cc4)=C3)ccc2c1,CC#N,539.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccc(C#N)cc4)=C3)ccc2c1,CC(C)=O,533.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccc(C#N)cc4)=C3)ccc2c1,CS(C)=O,559.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccc(C#N)cc4)=C3)ccc2c1,Cc1ccccc1,519.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccc(C#N)cc4)=C3)ccc2c1,ClC(Cl)Cl,532.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccc(C#N)cc4)=C3)ccc2c1,ClCCl,539.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccccc4)=C3)ccc2c1,C1CCOC1,492.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccccc4)=C3)ccc2c1,CC#N,503.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccccc4)=C3)ccc2c1,CC(C)=O,498.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccccc4)=C3)ccc2c1,CS(C)=O,520.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccccc4)=C3)ccc2c1,Cc1ccccc1,489.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccccc4)=C3)ccc2c1,ClC(Cl)Cl,500.0
CN(C)c1ccc2cc(C3=[O+][B-](F)(F)OC(c4ccccc4)=C3)ccc2c1,ClCCl,504.0
CN(C)c1ccc2cc3c(c(C=O)c2c1)CCC3,ClCCl,437.0
CN(C)c1ccc2cc3c(c([Si](C)(C)C)c2c1)C(=O)CC3,ClCCl,442.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,C1CCOC1,353.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,CC#N,456.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,CC(C)O,362.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,CCOC(C)=O,354.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,CN(C)C=O,362.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,CS(C)=O,359.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,Cc1ccccc1,355.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,ClCCl,450.0
CN(C)c1ccc2cc3c(cc2c1)OCCN=C3,O,451.0
CN(C)c1ccc2cc3ccc(N(C)C)cc3nc2c1,O,496.5
CN(C)c1ccc2ccc3oc(=O)c(-c4ccccc4)nc3c2c1,c1ccccc1,474.0
CN(C)c1ccc2nc(-c3ccc(C(=O)Nc4ccccc4)cc3)sc2c1,C1CCCCC1,385.5
CN(C)c1ccc2nc(-c3ccc(C(=O)Nc4ccccc4)cc3)sc2c1,CC#N,388.0
CN(C)c1ccc2nc(-c3ccc(C(=O)Nc4ccccc4)cc3)sc2c1,CC(C)O,389.0
CN(C)c1ccc2nc(-c3ccc(C(=O)Nc4ccccc4)cc3)sc2c1,CO,389.0
CN(C)c1ccc2nc(-c3ccc(C(=O)Nc4ccccc4)cc3)sc2c1,CS(C)=O,396.0
CN(C)c1ccc2nc(-c3ccc(C(=O)Nc4ccccc4)cc3)sc2c1,ClC(Cl)Cl,383.0
CN(C)c1ccc2nc(-c3ccc(C(=O)Nc4ccccc4)cc3)sc2c1,c1ccccc1,392.0
CN(C)c1ccc2nc(-c3ccc(C(=O)O)cc3)sc2c1,C1CCCCC1,387.0
CN(C)c1ccc2nc(-c3ccc(C(=O)O)cc3)sc2c1,CC#N,390.0
CN(C)c1ccc2nc(-c3ccc(C(=O)O)cc3)sc2c1,CC(C)O,374.0
CN(C)c1ccc2nc(-c3ccc(C(=O)O)cc3)sc2c1,CO,377.0
CN(C)c1ccc2nc(-c3ccc(C(=O)O)cc3)sc2c1,CS(C)=O,400.0
CN(C)c1ccc2nc(-c3ccc(C(=O)O)cc3)sc2c1,ClC(Cl)Cl,400.0
CN(C)c1ccc2nc(-c3ccc(C(=O)O)cc3)sc2c1,c1ccccc1,394.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC(C)(C)C)cc3)sc2c1,C1CCCCC1,384.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC(C)(C)C)cc3)sc2c1,CC#N,390.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC(C)(C)C)cc3)sc2c1,CC(C)O,392.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC(C)(C)C)cc3)sc2c1,CO,393.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC(C)(C)C)cc3)sc2c1,CS(C)=O,403.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC(C)(C)C)cc3)sc2c1,ClC(Cl)Cl,392.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC(C)(C)C)cc3)sc2c1,c1ccccc1,392.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc4ccccc4)cc3)sc2c1,C1CCCCC1,390.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc4ccccc4)cc3)sc2c1,CC#N,398.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc4ccccc4)cc3)sc2c1,CC(C)O,397.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc4ccccc4)cc3)sc2c1,CO,397.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc4ccccc4)cc3)sc2c1,CS(C)=O,408.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc4ccccc4)cc3)sc2c1,ClC(Cl)Cl,401.0
CN(C)c1ccc2nc(-c3ccc(C(=O)OC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc4ccccc4)cc3)sc2c1,c1ccccc1,397.0
CN(C)c1ccc2nc(-c3ccccc3)c(=O)oc2c1,c1ccccc1,436.0
CN(C)c1ccc2nc(-c3ccccc3)sc2c1,C1CCCCC1,357.0
CN(C)c1ccc2nc(-c3ccccc3)sc2c1,CC#N,362.0
CN(C)c1ccc2nc(-c3ccccc3)sc2c1,CC(C)O,361.0
CN(C)c1ccc2nc(-c3ccccc3)sc2c1,CO,363.0
CN(C)c1ccc2nc(-c3ccccc3)sc2c1,CS(C)=O,369.0
CN(C)c1ccc2nc(-c3ccccc3)sc2c1,ClC(Cl)Cl,362.0
CN(C)c1ccc2nc(-c3ccccc3)sc2c1,c1ccccc1,364.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,C1CCCCC1,438.5
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,C1COCCO1,453.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,CC#N,463.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,CC(C)=O,462.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,CCCCCCC,436.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,CCO,466.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,CCOC(C)=O,457.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,CN(C)C=O,469.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,CS(C)=O,475.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,Cc1ccccc1,459.5
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,ClC(Cl)Cl,467.0
CN(C)c1ccc2nc(/C=C/c3ccccc3)c(=O)oc2c1,ClCCl,467.5
CN(C)c1ccc2nc3c(cnc4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)cc43)cc2c1,ClCCl,453.0
CN(C)c1ccc2nc3ccc(N(C)C)cc3[s+]c2c1,CC#N,655.0
CN(C)c1ccc2nc3ccc(N(C)C)cc3[s+]c2c1,CCO,655.0
CN(C)c1ccc2nc3ccc(N(C)C)cc3[s+]c2c1,O,664.0
CN(C)c1ccc2nc3ccc(N(C)C)cc3[s+]c2c1,OCC(O)CO,662.0
CN(C)c1ccc2nn(C)c(-c3ccc(C=C(C#N)C#N)o3)c2c1,ClCCl,531.0
CN(C)c1ccc2nn(C)c(-c3ccc(C=C(C#N)C#N)s3)c2c1,ClCCl,535.0
CN(C)c1ccc2nn(C)c(-c3ccc(C=O)o3)c2c1,CC#N,411.0
CN(C)c1ccc2nn(C)c(-c3ccc(C=O)o3)c2c1,ClCCl,420.0
CN(C)c1cccc(-c2ccc(-c3cccc(N(C)C)c3)c3[nH]c(-c4ccc(/C=C(\C#N)C(=O)O)cc4)nc23)c1,ClC(Cl)Cl,274.0
CN(C)c1cccc(-c2ccc(-c3cccc(N(C)C)c3)c3[nH]c(-c4ccc(/C=C(\C#N)C(=O)O)cc4)nc23)c1,ClCCl,235.0
CN(C)c1cccc(-c2ccc(-c3cccc(N(C)C)c3)c3[nH]c(-c4ccc(C=C(C#N)C(=O)O)cc4)nc23)c1,ClC(Cl)Cl,274.0
CN(C)c1cccc(/C=C/c2ncc(-c3ccc(OCc4ccccc4)c(OCc4ccccc4)c3)o2)c1,ClCCl,350.0
CN(C)c1cccc(C#N)c1,CC#N,340.5850091
CN(C)c1cccc(C#N)c1,CCCCCC,330.4387569
CN(C)c1cccc(C=Cc2ccccc2)c1[N+](=O)[O-],ClC(Cl)Cl,427.0
CN(C)c1cccc2c(S(=O)(=O)NCCCCCC(=O)ON3C(=O)CCC3=O)cccc12,CO,335.0
CN(C)c1cccc2c(S(=O)(=O)NCCCCCN)cccc12,CO,334.5
CN(C)c1cccc2c(S(=O)(=O)NN)cccc12,CO,336.0
CN(C)c1cccc2c1-c1ccccc1C2=O,C1CCCCC1,412.0
CN(C)c1cccc2c1-c1ccccc1C2=O,CC#N,439.0
CN(C)c1cccc2c1-c1ccccc1C2=O,CCO,438.0
CN(C)c1cccc2c1-c1ccccc1C2=O,c1ccccc1,433.0
CN(C)c1cccc2c1C(=O)c1ccccc1-2,C1CCCCC1,433.0
CN(C)c1cccc2c1C(=O)c1ccccc1-2,CC#N,444.0
CN(C)c1cccc2c1C(=O)c1ccccc1-2,CCO,449.0
CN(C)c1cccc2c1C(=O)c1ccccc1-2,c1ccccc1,445.0
CN(C)c1cccc2c1C(=O)c1ccccc1C2=O,C1CCCCC1,487.0
CN(C)c1cccc2c1C(=O)c1ccccc1C2=O,CC#N,502.0
CN(C)c1cccc2c1C(=O)c1ccccc1C2=O,CC1CCCCC1,487.5
CN(C)c1cccc2c1C(=O)c1ccccc1C2=O,CCC(C)CC,487.0
CN(C)c1cccc2c1C(=O)c1ccccc1C2=O,CCCCCC,487.5
CN(C)c1cccc2c1C(=O)c1ccccc1C2=O,CCOC(C)=O,498.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CC(C)=O,392.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCCCCCCCO,395.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCCCO,394.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCCO,393.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCO,393.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CCOC(C)=O,393.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CN(C)C=O,395.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,CO,391.0
CN(C)c1cccc2c1ccc1c(=O)oc(-c3ccc(C(F)(F)F)cc3)cc12,ClC(Cl)Cl,395.0
CN(C)c1ccccc1,C1CCCCC1,293.9447384
CN(C)c1nc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)nc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1,CN(C)C=O,374.0
CN(C)c1nc(-c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)nc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1,CN(C)C=O,395.0
CN(C)c1nc(-c2ccc(Br)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,C1CCOC1,469.0
CN(C)c1nc(-c2ccc(Br)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,CC#N,478.0
CN(C)c1nc(-c2ccc(Br)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,CCCCCC,436.0
CN(C)c1nc(-c2ccc(Br)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,CS(C)=O,494.0
CN(C)c1nc(-c2ccc(Br)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,Cc1ccccc1,464.0
CN(C)c1nc(-c2ccc(Br)cc2)c(-c2ccc([N+](=O)[O-])s2)s1,ClCCl,479.0
CN(C)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,C1CCOC1,455.0
CN(C)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,CC#N,465.0
CN(C)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,CCCCCC,425.0
CN(C)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,CS(C)=O,475.0
CN(C)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,Cc1ccccc1,457.0
CN(C)c1nc(-c2ccccc2)c(-c2ccc([N+](=O)[O-])o2)s1,ClCCl,469.0
CN(C)c1nc(N(C)C)c2nc(/C=C/c3ccccc3)n(C)c2n1,ClCCl,395.0
CN(C)c1nc(N(C)C)c2nc(C#N)n(Cc3ccccc3)c2n1,C1COCCO1,345.0
CN(C)c1nc(N(C)C)c2nc(C#N)n(Cc3ccccc3)c2n1,CC#N,344.0
CN(C)c1nc(N(C)C)c2nc(C#N)n(Cc3ccccc3)c2n1,CO,342.0
CN(C)c1nc(N(C)C)c2nc(C#N)n(Cc3ccccc3)c2n1,ClCCl,348.0
CN(C)c1nc(N)c2nc(C#N)n(Cc3ccccc3)c2n1,C1COCCO1,339.0
CN(C)c1nc(N)c2nc(C#N)n(Cc3ccccc3)c2n1,CC#N,338.0
CN(C)c1nc(N)c2nc(C#N)n(Cc3ccccc3)c2n1,CO,338.0
CN(C)c1nc(N)c2nc(C#N)n(Cc3ccccc3)c2n1,ClCCl,336.0
CN(C)c1nc(N)nc2c1nc(C#N)n2Cc1ccccc1,C1COCCO1,334.0
CN(C)c1nc(N)nc2c1nc(C#N)n2Cc1ccccc1,CC#N,326.0
CN(C)c1nc(N)nc2c1nc(C#N)n2Cc1ccccc1,CO,327.0
CN(C)c1nc(N)nc2c1nc(C#N)n2Cc1ccccc1,ClCCl,324.0
CN(C)c1ncc2nc(C#N)n(Cc3ccccc3)c2n1,C1COCCO1,355.0
CN(C)c1ncc2nc(C#N)n(Cc3ccccc3)c2n1,CC#N,357.0
CN(C)c1ncc2nc(C#N)n(Cc3ccccc3)c2n1,CO,358.0
CN(C)c1ncc2nc(C#N)n(Cc3ccccc3)c2n1,ClCCl,361.0
CN(CC(=O)O)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](C)CC(=O)O)C=C3)C2=O)cc1,C1CCOC1,622.0
CN(CC(=O)O)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](C)CC(=O)O)C=C3)C2=O)cc1,CN(C)C=O,628.0
CN(CC(=O)O)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](C)CC(=O)O)C=C3)C2=O)cc1,CO,640.0
CN(CC(=O)O)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](C)CC(=O)O)C=C3)C2=O)cc1,CS(C)=O,652.0
CN(CC(=O)O)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](C)CC(=O)O)C=C3)C2=O)cc1,Cc1ccccc1,625.0
CN(CC(=O)O)c1ccc(C2=C([O-])C(=C3C=CC(=[N+](C)CC(=O)O)C=C3)C2=O)cc1,c1ccccc1,627.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,C1CCCCC1,400.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,C1CCOC1,411.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,C1COCCO1,396.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,CC#N,402.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,CC(C)O,412.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,CCOC(C)=O,418.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,CCOCC,405.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,CO,409.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,Cc1ccccc1,414.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,ClC(Cl)Cl,369.0
CN(CC(O)c1cccc(O)c1)c1ccc([N+](=O)[O-])c(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)c1,O,406.0
CN(CCCC(=O)O)C(=O)c1ccccc1-c1c2cc3c(cc2[o+]c2cc4c(cc12)C(CS(=O)(=O)O)=CC(C)(C)N4CCCS(N)(=O)=O)N(CCC[SH](N)(=O)O)C(C)(C)C=C3CS(=O)(=O)[O-],O,600.0
CN(CCCC(=O)O)C(=O)c1ccccc1-c1c2cc3c(cc2[o+]c2cc4c(cc12)C(CS(=O)(=O)[O-])=CC(C)(C)N4CCC[SH](N)(=O)O)N(CCCS(N)(=O)=O)C(C)(C)C=C3CS(=O)(=O)[O-],O,600.0
CN(CCCC(=O)O)C(=O)c1ccccc1-c1c2ccc(NCCCS(=O)(=O)O)cc2[o+]c2cc(NCCCS(=O)(=O)O)ccc12,O,533.0
CN(CCCC(=O)O)C(=O)c1ccccc1-c1c2ccc(NCCCS(=O)(=O)[O-])cc2[o+]c2cc(NCCCS(=O)(=O)O)ccc12,O,533.0
CN(CCCC(=O)[O-])C(=O)c1ccccc1-c1c2cc/c(=[NH+]\CC(F)(F)F)c(S(=O)(=O)O)c-2oc2c(S(=O)(=O)O)c(NCC(F)(F)F)ccc12,O,511.0
CN(CCCC(=O)[O-])C(=O)c1ccccc1-c1c2ccc(=[N+](C)C)cc-2sc2cc(N(C)C)ccc12,O,579.0
CN(CCCC(=O)[O-])C(=O)c1ccccc1-c1c2ccc(=[NH2+])c(S(=O)(=O)O)c-2oc2c(S(=O)(=O)O)c(N)ccc12,O,500.0
CN(CCCCCC(=O)O)c1ccc([N+](=O)[O-])c2nonc12,CO,467.0
CN(CCCCCC(=O)ON1C(=O)C=CC1=O)c1ccc([N+](=O)[O-])c2nonc12,CO,466.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)C(C)(C)C)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)C3C=CCCC3)cc2)cc1,CS(C)=O,428.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)C3CC3)cc2)cc1,CS(C)=O,426.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)C3CCC3)cc2)cc1,CS(C)=O,428.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)C3CCCC3)cc2)cc1,CS(C)=O,426.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)CC3CCCC3)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)CCC3CCCC3)cc2)cc1,CS(C)=O,428.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)CCCCCCl)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)CCc3ccccc3)cc2)cc1,CS(C)=O,428.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)COc3ccc(Cl)cc3)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2)cc1,CS(C)=O,428.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)Cc3ccc(F)cc3)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)N3CCOCC3)cc2)cc1,CS(C)=O,425.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(C(F)(F)F)ccc(Cl)c3F)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(F)c(F)c(Cl)c(F)c3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(F)c(F)c(F)c(Br)c3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(F)c(F)c(F)c(F)c3Br)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(F)c(F)c(F)c(F)c3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(F)ccc(Cl)c3F)cc2)cc1,CS(C)=O,433.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(F)ccc(F)c3Cl)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3c(F)cccc3C(F)(F)F)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(C(F)(F)F)cc(Cl)c3F)cc2)cc1,CS(C)=O,433.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(C(F)(F)F)ccc3Cl)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(C(F)(F)F)ccc3F)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(F)c(Cl)cc3Cl)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(F)cc(C(F)(F)F)c3)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(F)ccc3C(F)(F)F)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(F)ccc3Cl)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(F)ccc3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc(I)ccc3F)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4ccc(Cl)c([N+](=O)[O-])c4)o3)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4ccc(F)cc4)o3)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4cccc(Cl)c4Cl)o3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4ccccc4)cc3)cc2)cc1,CS(C)=O,439.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4ccccc4)o3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4ccccc4F)o3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(-c4ccccc4[N+](=O)[O-])o3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(Br)cc3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(Br)cc3F)cc2)cc1,CS(C)=O,433.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(C(F)(F)F)c(F)c3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(C(F)(F)F)cc3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2)cc1,CS(C)=O,425.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(F)c(C(F)(F)F)c3)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(F)c(Cl)c3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(F)c(Cl)c3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(F)cc3Cl)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(F)cc3F)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc(I)cc3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)cc1,CS(C)=O,433.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccc(Br)c3)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccc(C(F)(F)F)c3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccc(Cl)c3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccc(Cl)c3Cl)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccc(Cl)c3F)cc2)cc1,CS(C)=O,432.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccc(F)c3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccc(I)c3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccccc3)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccccc3Br)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccccc3Cl)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccccc3I)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccn3C)cc2)cc1,CS(C)=O,428.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccnc3)cc2)cc1,CS(C)=O,428.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccnc3Cl)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3ccco3)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cccs3)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3cnccn3)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3sc(Cl)c(Cl)c3Cl)cc2)cc1,CS(C)=O,429.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3sc4cc(F)ccc4c3Cl)cc2)cc1,CS(C)=O,430.0
CN(CCO)c1ccc(/C=C/C(=O)c2ccc(NC(=O)c3sc4ccccc4c3Cl)cc2)cc1,CS(C)=O,431.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,CC#N,586.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,CC(C)=O,574.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,CCO,579.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,CCOC(C)=O,565.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,CN(C)C=O,588.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,CO,575.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,CS(C)=O,595.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,Cc1ccccc1,562.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,ClCCl,575.0
CN(CCO)c1ccc(/C=C/C2=C(C#N)C(C(C#N)C#N)OC2(C)C)cc1,O,587.0
CN(CCO)c1ccc(/C=C/C2=CC(=C(C#N)C#N)CC(C)(C)C2)cc1,CC#N,500.0
CN(CCO)c1ccc(/C=C/C2=CC(=C(C#N)C#N)CC(C)(C)C2)cc1,CC(C)=O,504.0
CN(CCO)c1ccc(/C=C/C2=CC(=C(C#N)C#N)CC(C)(C)C2)cc1,CCCCO,510.0
CN(CCO)c1ccc(/C=C/C2=CC(=C(C#N)C#N)CC(C)(C)C2)cc1,ClC(Cl)Cl,499.0
CN(CCO)c1ccc(/C=C/C2=CC(=C(C#N)C#N)CC(C)(C)C2)cc1,ClCCl,497.0
CN(CCO)c1ccc(/C=C/C2=CC(=C(C#N)C#N)CC(C)(C)C2)cc1,c1ccccc1,493.0
CN(CCOC(=O)CI)c1ccc([N+](=O)[O-])c2nonc12,CO,472.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)s2)cc1,C1CCOC1,474.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)cc3)c3nsnc23)cc1,C1CCOC1,471.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)cc1,C1CCOC1,474.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)c3nsnc23)cc1,C1CCOC1,471.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)c3nsnc23)cc1,ClCCl,471.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(/C=C(/C#N)C(=O)O)s2)cc1,C1CCOC1,470.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(C=C(C#N)C(=O)O)c3nsnc23)cc1,C1CCOC1,524.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(C=C(C#N)C(=O)O)c3nsnc23)cc1,ClCCl,524.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(C=C(C#N)C(=O)O)s2)cc1,C1CCOC1,470.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(-c2ccc(C=C(C#N)C(=O)O)s2)cc1,ClCCl,470.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(/C=C/c2ccc(C=C(C#N)C(=O)O)s2)cc1,C1CCOC1,491.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(/C=C/c2ccc(C=C(C#N)C(=O)O)s2)cc1,ClCCl,491.0
CN(CCO[Si](C)(C)C(C)(C)C)c1ccc(/C=C\c2ccc(/C=C(\C#N)C(=O)O)s2)cc1,C1CCOC1,491.0
CN(c1ccccc1)c1c([O-])/c(=[N+](\C)c2ccccc2)c1=O,CN(C)C=O,387.0
CN(c1ccccc1)c1ccc(-c2cc3ccc4cc(-c5ccc(N(C)c6ccccc6)cc5)nc5c6ccccc6c(n2)c3c45)cc1,Cc1ccccc1,384.0
CN(c1ccccc1)c1ccc(-c2cc3cccc4c5nc(-c6ccc(N(C)c7ccccc7)cc6)cc6cccc(c(n2)c34)c65)cc1,Cc1ccccc1,351.0
CN(c1ccccc1)c1ccc(-c2ccc(-c3ccc(N(C)c4ccccc4)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)cc1,ClC(Cl)Cl,476.0
CN(c1ccccc1)c1ccc(/C=C/c2ccccc2)cc1,CC#N,354.0
CN(c1ccccc1)c1ccc(/C=C/c2ccccc2)cc1,CCCCCC,352.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,C1CCOC1,468.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,C1COCCO1,466.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,CC#N,471.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,CC(C)=O,470.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,CCOC(C)=O,465.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,CN(C)C=O,478.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,CO,475.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,CS(C)=O,483.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,Cc1ccccc1,472.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,ClC(Cl)Cl,479.0
CN(c1ccccc1)c1ccc(/C=C2\C(=O)c3ccccc3S2(=O)=O)cc1,ClCCl,476.0
CN1/C(=C/C2=C([O-])C(=O)C2=C2C(=O)NC(=O)NC2=O)C(C)(C)c2ccccc21,CCO,457.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2cc(F)cc(F)c2)C(C)(C)c2ccccc21,CCO,636.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2cc(F)cc(F)c2)C(C)(C)c2ccccc21,CO,633.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2cc(F)cc(F)c2)C(C)(C)c2ccccc21,CS(C)=O,644.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2cc(F)cc(F)c2)C(C)(C)c2ccccc21,O,631.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(C(F)(F)F)cc2)C(C)(C)c2ccccc21,CCO,637.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(C(F)(F)F)cc2)C(C)(C)c2ccccc21,CO,634.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(C(F)(F)F)cc2)C(C)(C)c2ccccc21,CS(C)=O,643.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(C(F)(F)F)cc2)C(C)(C)c2ccccc21,O,632.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(F)cc2)C(C)(C)c2ccccc21,CCO,639.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(F)cc2)C(C)(C)c2ccccc21,CO,636.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(F)cc2)C(C)(C)c2ccccc21,CS(C)=O,643.0
CN1/C(=C/C=C(/C=C/C2=[N+](C)c3ccccc3C2(C)C)c2ccc(F)cc2)C(C)(C)c2ccccc21,O,633.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cc(F)cc(F)c2)Sc2ccccc21,CCO,644.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cc(F)cc(F)c2)Sc2ccccc21,CO,641.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cc(F)cc(F)c2)Sc2ccccc21,CS(C)=O,651.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cc(F)cc(F)c2)Sc2ccccc21,O,638.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(C(F)(F)F)cc2)Sc2ccccc21,CCO,646.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(C(F)(F)F)cc2)Sc2ccccc21,CO,643.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(C(F)(F)F)cc2)Sc2ccccc21,CS(C)=O,652.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(C(F)(F)F)cc2)Sc2ccccc21,O,639.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(F)cc2)Sc2ccccc21,CCO,648.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(F)cc2)Sc2ccccc21,CO,646.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(F)cc2)Sc2ccccc21,CS(C)=O,656.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccc(F)cc2)Sc2ccccc21,O,641.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cccc(C(F)(F)F)c2)Sc2ccccc21,CCO,645.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cccc(C(F)(F)F)c2)Sc2ccccc21,CO,642.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cccc(C(F)(F)F)c2)Sc2ccccc21,CS(C)=O,653.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2cccc(C(F)(F)F)c2)Sc2ccccc21,O,639.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccccc2)Sc2ccccc21,CCO,651.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccccc2)Sc2ccccc21,CO,647.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccccc2)Sc2ccccc21,CS(C)=O,645.0
CN1/C(=C/C=C(/C=C/c2sc3ccccc3[n+]2C)c2ccccc2)Sc2ccccc21,O,641.0
CN1/C(=C/C=C/C2=[N+](C)c3c(F)c(F)c4c(F)c(F)c(F)c(F)c4c3C2(C)C)C(C)(C)c2c1c(F)c(F)c1c(F)c(F)c(F)c(F)c21,ClCCl,542.0
CN1/C(=C/C=C/C2=[N+](C)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2c1ccc1ccccc21,ClCCl,554.0
CN1/C(=C/C=C/C2=[N+](C)c3ccccc3C2(C)C)Sc2ccccc21,CS(C)=O,549.0
CN1/C(=C/C=C/C2=[N+](CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,548.0
CN1/C(=C/C=C/C=C\C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2cc(CC(=O)O)ccc21,CCO,660.0
CN1/C(=C/C=C/C=N/c2sc3ccccc3[n+]2C)C(C)(C)c2ccccc21,CS(C)=O,579.0
CN1/C(=C/C=C/C=O)C(C)(C)c2ccccc21,CS(C)=O,410.0
CN1/C(=C/C=N/c2sc3ccccc3[n+]2C)C(C)(C)c2ccccc21,CS(C)=O,469.0
CN1/C(=C/C=O)C(C)(C)c2ccccc21,CS(C)=O,338.0
CN1/C(=C\C2=C([O-])/C(=C/C3=[N+](C)c4ccc(-n5c(-c6ccc(-c7ccc(-c8ccc(/C=C(/C#N)C(=O)O)s8)s7)cc6)nc6c7ccccc7c7ccccc7c65)cc4C3(C)C)C2=O)C(C)(C)c2ccccc21,CN(C)C=O,641.0
CN1/C(=C\C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2cc(CC(=O)O)ccc21,CCO,443.0
CN1/C(=C\C=C\C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)C(C)(C)c2ccccc21,CC#N,671.0
CN1/C(=C\C=C\C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)Sc2ccccc21,CC#N,683.0
CN1/C(=C\C=C\C2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2cc(CC(=O)O)ccc21,CCO,555.0
CN1/C(=C\C=C\C=C\C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)C(C)(C)c2ccccc21,CC#N,771.0
CN1B(c2c(F)c(F)c(F)c(F)c2F)c2cc3c(cc2-c2ccccc21)B(c1c(F)c(F)c(F)c(F)c1F)N(C)c1ccccc1-3,C1CCCCC1,379.0
CN1B(c2c(F)c(F)c(F)c(F)c2F)c2ccccc2-c2cc3ccccc3cc21,C1CCCCC1,369.0
CN1B(c2c(F)c(F)c(F)c(F)c2F)c2ccccc2-c2ccccc21,C1CCCCC1,331.0
CN1C(=CC2=C(O)C(=O)C2=C2C(=O)c3ccccc3C2=O)C(C)(C)c2ccccc21,CCO,492.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccc(-c5ccccc5)cc4C3(C)C)C2=O)C(C)(C)c2cc(-c3ccccc3)ccc21,ClC(Cl)Cl,658.5
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccc(Cl)cc4C3(C)C)C2=O)C(C)(C)c2cc(Cl)ccc21,CO,635.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccc(Cl)cc4C3(C)C)C2=O)C(C)(C)c2cc(Cl)ccc21,ClC(Cl)Cl,641.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccc(Cl)cc4C3(C)C)C2=O)C(C)(C)c2cc(Cl)ccc21,ClCCl,641.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,ClC(Cl)Cl,684.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=C2C(=O)NC(=O)NC2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,644.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=C2C(=O)c3ccccc3C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,675.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=NC#N)C(C)(C)c2ccccc21,ClC(Cl)Cl,655.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc(Cl)ccc21,CO,629.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc(Cl)ccc21,ClC(Cl)Cl,637.0
CN1C(=CC2=C([O-])C(=CC3=[N+](C)c4ccccc4C3(C)C)C2=O)C(C)(C)c2cc(Cl)ccc21,ClCCl,638.0
CN1C(=CC2=C([O-])C(=Cc3oc(-c4ccc(-c5ccccc5)cc4)c[n+]3C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,ClC(Cl)Cl,648.0
CN1C(=CC2=C([O-])C(=Cc3oc(-c4ccc(-c5ccccc5)cc4)c[n+]3C)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,606.0
CN1C(=CC2=C([O-])C(=Cc3oc4ccccc4[n+]3C)C2=C(C#N)C#N)C(C)(C)c2ccccc21,ClC(Cl)Cl,655.0
CN1C(=CC2=C([O-])C(=Cc3oc4ccccc4[n+]3C)C2=C(C#N)C#N)Sc2ccccc21,ClC(Cl)Cl,664.0
CN1C(=CC2=C([O-])C(=Cc3oc4ccccc4[n+]3C)C2=O)C(C)(C)c2ccccc21,ClC(Cl)Cl,608.0
CN1C(=CC2=C([O-])C(=Cc3sc4ccccc4[n+]3C)C2=C(C#N)C#N)Sc2ccccc21,ClC(Cl)Cl,703.0
CN1C(=CC2=C([O-])C(=O)C2=C(C#N)C#N)C(C)(C)c2ccccc21,CCO,460.0
CN1C(=CC2=C([O-])C(=O)C2=C(C#N)C#N)C=Cc2ccccc21,CCO,515.0
CN1C(=CC2=C([O-])C(=O)C2=C(C#N)C#N)Sc2ccccc21,CCO,481.0
CN1C(=CC=C2C=CC(=O)c3ncccc32)C(C)(C)c2cc([N+](=O)[O-])ccc21,CC#N,526.0
CN1C(=CC=C2C=CC(=O)c3ncccc32)C(C)(C)c2ccccc21,C1CCOC1,605.0
CN1C(=CC=C2C=CC(=O)c3ncccc32)Sc2ccccc21,C1CCOC1,605.0
CN1C(=CC=C2CC(C(C)(C)C)CC(C=CC3=C(C#N)C(=C(C#N)C#N)OC3(C)C)=C2Br)C(C)(C)c2ccccc21,CN(C)C=O,843.0
CN1C(=CC=C2CC(c3ccccc3)(c3ccccc3)CC(C=CC3=C(C#N)C(=C(C#N)C#N)OC3(C)C)=C2Br)C(C)(C)c2ccccc21,CN(C)C=O,839.0
CN1C(=CC=C2CC(c3ccccc3)(c3ccccc3)CC(C=CC3=C(C#N)C(=C(C#N)C#N)OC3(C)C)=C2Cl)C(C)(C)c2ccccc21,CN(C)C=O,839.0
CN1C(=CC=C2c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3-c3c2cc([N+](=O)[O-])cc3[N+](=O)[O-])C(C)(C)c2ccccc21,Cc1ccccc1,640.0
CN1C(=CC=CC=CC2=C(C#N)C(=C(C#N)C#N)OC2(C)C)C(C)(C)c2ccccc21,CN(C)C=O,698.0
CN1C(=CC=CC=CC=C2c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3-c3c2cc([N+](=O)[O-])cc3[N+](=O)[O-])C(C)(C)c2ccccc21,Cc1ccccc1,773.0
CN1C(=CC=CC=CC=CC2=C(C#N)C(=C(C#N)C#N)OC2(C)C)C(C)(C)c2ccccc21,CN(C)C=O,810.0
CN1C(=CC=Cc2nc3nc4ccccc4nc3s2)C(C)(C)c2ccccc21,CO,530.0
CN1C(=CN=Nc2ccc(C=C(C#N)C#N)cc2)C(C)(C)c2ccccc21,C1CCOC1,540.0
CN1C(=CN=Nc2ccc(C=C3C(=C(C#N)C#N)CC(C)(C)CC3=C(C#N)C#N)cc2)C(C)(C)c2ccccc21,C1CCOC1,429.0
CN1C(=CN=Nc2ccc(C=C3SC(=S)N(c4ccc(O)cc4)C3=O)cc2)C(C)(C)c2ccccc21,C1CCOC1,525.0
CN1C(=CN=Nc2ccc(C=C3SC(=S)N(c4ccc(O)cc4)C3=O)cc2)Sc2ccccc21,CN(C)C=O,569.0
CN1C(=CN=Nc2ccc(C=CC3=C(C#N)C(=C(C#N)C#N)OC3(C)C)cc2)Sc2ccccc21,C1CCOC1,637.0
CN1C(=CN=Nc2ccc3c4c(cccc24)C(=O)NC3=O)C(C)(C)c2ccccc21,C1CCOC1,531.0
CN1C(=Cc2c([S-])c(=O)c2=O)C(C)(C)c2ccccc21,CCO,446.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccccc1,C1COCCO1,411.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccccc1,CC#N,408.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccccc1,CCO,411.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccccc1,CCOC(C)=O,408.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccccc1,O,408.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccncc1,C1COCCO1,408.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccncc1,CC#N,408.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccncc1,CCO,408.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccncc1,CCOC(C)=O,408.0
CN1C(=O)/C(=C/c2ccncc2)N=C1/C=C/c1ccncc1,O,402.0
CN1C(=O)/C(=C/c2ccncc2)N=C1c1ccccc1,C1COCCO1,379.0
CN1C(=O)/C(=C/c2ccncc2)N=C1c1ccccc1,CC#N,377.0
CN1C(=O)/C(=C/c2ccncc2)N=C1c1ccccc1,CCO,377.0
CN1C(=O)/C(=C/c2ccncc2)N=C1c1ccccc1,CCOC(C)=O,379.0
CN1C(=O)/C(=C/c2ccncc2)N=C1c1ccccc1,O,368.0
CN1C(=O)C(=CC=C2C=C(c3ccccc3)C=C(c3ccccc3)O2)C(=O)N(C)C1=O,ClCCl,561.0
CN1C(=O)C(=CC=CC=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)C(=O)N(C)C1=S,ClCCl,620.0
CN1C(=O)C(N=Nc2nc(-c3cc4ccccc4oc3=O)cs2)C(=O)N(C)C1=O,CS(C)=O,417.0
CN1C(=O)c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C1=O,C1CCOC1,408.0
CN1C(=O)c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C1=O,CCCCCC,402.0
CN1C(=O)c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C1=O,ClC(Cl)Cl,404.0
CN1C(=O)c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C1=O,ClCCl,414.0
CN1C(=O)c2cccc3cc(N=Cc4ccc(-c5cccs5)s4)cc(c23)C1=O,ClC(Cl)Cl,387.0
CN1C(=O)c2cccc3cc(N=Cc4ccc(C=Nc5cc6c7c(cccc7c5)C(=O)N(C)C6=O)s4)cc(c23)C1=O,ClC(Cl)Cl,389.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O,C1COCCO1,326.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O,CC#N,334.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O,CCCCO,330.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O,CCCO,330.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O,CCO,331.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O,CCOC(C)=O,324.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O,CO,333.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O,C1COCCO1,344.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O,CC#N,355.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O,CCCCO,350.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O,CCCO,350.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O,CCO,351.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O,CCOC(C)=O,342.0
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O,CO,354.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2ccccc2S1(=O)=O,CC#N,367.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2ccccc2S1(=O)=O,CCCCO,363.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2ccccc2S1(=O)=O,CCCO,361.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2ccccc2S1(=O)=O,CCO,361.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2ccccc2S1(=O)=O,CO,359.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2sccc2S1(=O)=O,CC#N,382.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2sccc2S1(=O)=O,CCCCO,377.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2sccc2S1(=O)=O,CCCO,376.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2sccc2S1(=O)=O,CCO,375.0
CN1C(C(=O)Nc2ccccn2)=C([O-])c2sccc2S1(=O)=O,CO,373.0
CN1C2=Nc3n(C)c4ccccc4[n+]3CN2c2ccccc21,CO,339.0
CN1C=CC(=CC=C2C=C(Cl)c3cccnc3C2=O)C=C1,C1CCOC1,623.0
CN1C=CC(=CN=Nc2ccc(C=C(C#N)C#N)cc2)c2ccccc21,CN(C)C=O,550.0
CN1C=CC(=CN=Nc2ccc(CC3SC(=S)N(c4ccc(O)cc4)C3=O)cc2)c2ccccc21,C1CCOC1,564.0
CN1C=CC=CC1=CC=C1C=C(Cl)c2cccnc2C1=O,C1CCOC1,592.0
CN1C=C[CH2+]=CC1,CS(C)=O,637.0
CN1CC2CCCN2c2cc3c(cc21)C(c1ccccc1C(=O)[O-])=c1cc2c4c(c1O3)CCC[N+]=4CCC2,O,586.0
CN1CCCc2cc3c(C(F)(F)F)cc(=O)oc3cc21,C1CCCCC1,382.0
CN1CCCc2cc3c(C(F)(F)F)cc(=O)oc3cc21,CC#N,405.0
CN1CCCc2cc3c(C(F)(F)F)cc(=O)oc3cc21,CCO,408.0
CN1CCCc2cc3c(cc21)Oc1cc2c(cc1=N3)OCC[N+]=2C,CO,649.0
CN1CCN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)CC1,CCO,611.0
CN1CCN(c2c(F)cc3c(c2F)OC2=C(/C=C/C4=[N+](C)c5ccccc5C4(C)C)CCCC2=C3)CC1,ClC(Cl)Cl,619.0
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,C1CCCCC1,428.2
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,C1CCOC1,446.0
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,C1COCCO1,442.8
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CC#N,453.8
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CC(C)=O,449.6
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CC1COC(=O)O1,459.0
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CCCCCCCCO,451.0
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CCCCCO,456.4
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CCCCO,454.6
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CCCO,455.4
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CCO,455.4
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CCOC(C)=O,443.0
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CN(C)C=O,454.4
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CO,456.4
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,CS(C)=O,460.8
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,Cc1ccccc1,443.8
CN1CCN(c2ccc3c4c(cccc24)C(=O)c2ccccc2-3)CC1,ClC(Cl)Cl,455.4
CN1CCN(c2cccc(/C=C/c3ncc(-c4ccc(OCc5ccccc5)c(OCc5ccccc5)c4)o3)c2)CC1,ClCCl,354.0
CN1CCSc2cc3c(cc21)Oc1cc2c(cc1=N3)OCC[N+]=2C,CO,659.0
CN1CCc2cc(C3=Cc4cccc[n+]4[B-](F)(F)O3)ccc21,ClC(Cl)Cl,430.0
CN1c2cc3c(cc2-c2c(n(C)c4ccccc24)C1(C)c1ccccc1)C(c1ccc(S(=O)(=O)[O-])cc1S(=O)(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(c1ccccc1)c1c-2c2ccccc2n1C,CO,634.0
CN1c2cc3c(cc2-c2ccc4ccccc4c2C1(C)C)C(c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1c-2ccc2ccccc12,CO,627.0
CN1c2cc3c(cc2-c2ccccc2C1(C)C)C(c1ccccc1C(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1ccccc1-2,CO,582.0
CN1c2cc3c(cc2-c2sc4ccccc4c2C1(C)C)C(c1ccc(S(=O)(=O)[O-])cc1S(=O)(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1c-2sc2ccccc12,CO,616.0
CN1c2cc3c(cc2-c2sc4ccccc4c2C1(C)C)C(c1ccccc1C(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1c-2sc2ccccc12,CO,600.0
CN1c2cc3c(cc2-c2sccc2C1(C)C)C(c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1ccsc1-2,CO,631.0
CN1c2cc3c(cc2-c2sccc2C1(C)C)C(c1c(F)c(F)c(F)c(F)c1C(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1ccsc1-2,CO,628.0
CN1c2cc3c(cc2-c2sccc2C1(C)C)C(c1ccc(S(=O)(=O)[O-])cc1S(=O)(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1ccsc1-2,CO,610.0
CN1c2cc3c(cc2-c2sccc2C1(C)C)C(c1ccccc1C(=O)[O-])=c1cc2c(cc1O3)=[N+](C)C(C)(C)c1ccsc1-2,CO,596.0
CN1c2cc3nc4cc(Br)c(Br)cc4nc3cc2N(C)C1(C)C,CCO,473.0
CN1c2cc3nc4cc(Cl)c(Cl)cc4nc3cc2N(C)C1(C)C,CCO,471.0
CN1c2cc3nc4cc(F)c(F)cc4nc3cc2N(C)C1(C)C,CCO,457.0
CN1c2ccc(C(=O)c3ccccc3)cc2Sc2cc(C(=O)c3ccccc3)ccc21,C1CCCCC1,390.0
CN1c2ccc(C(=O)c3ccccc3)cc2Sc2cc(C(=O)c3ccccc3)ccc21,C1CCOC1,402.0
CN1c2ccc(C(=O)c3ccccc3)cc2Sc2cc(C(=O)c3ccccc3)ccc21,CN(C)C=O,407.0
CN1c2ccc(C(=O)c3ccccc3)cc2Sc2cc(C(=O)c3ccccc3)ccc21,Cc1ccccc1,405.0
CN1c2ccc(C(=O)c3ccccc3)cc2Sc2cc(C(=O)c3ccccc3)ccc21,ClC(Cl)Cl,407.0
CN1c2ccc(C(=O)c3ccccc3)cc2Sc2cc(C(=O)c3ccccc3)ccc21,ClCCl,408.0
CN1c2ccc(C(F)(F)F)cc2C(C)(C)C12CCc1cc([N+](=O)[O-])ccc1O2,CC#N,205.0
CN1c2ccc(Cl)cc2C(C)(C)C12C=Cc1c(c(-c3nc(-c4ccccc4)c(-c4ccccc4)o3)cc3ccccc13)O2,Cc1ccccc1,306.0
CN1c2ccc3c(c2-c2ccccc2S1(=O)=O)-c1ccccc1S(=O)(=O)N3C,ClCCl,350.0
CN1c2ccccc2C(O)(c2ccccc2)c2cc([N+](=O)[O-])ccc21,C1CCOC1,392.4
CN1c2ccccc2C(O)(c2ccccc2)c2cc([N+](=O)[O-])ccc21,CC#N,396.9
CN1c2ccccc2C(O)(c2ccccc2)c2cc([N+](=O)[O-])ccc21,CCO,393.7
CN1c2ccccc2C(O)(c2ccccc2)c2cc([N+](=O)[O-])ccc21,CO,396.0
CN1c2ccccc2C(O)(c2ccccc2)c2cc([N+](=O)[O-])ccc21,CS(C)=O,410.0
CN1c2ccccc2C(O)(c2ccccc2)c2cc([N+](=O)[O-])ccc21,Cc1ccccc1,381.5
CN1c2ccccc2CCc2ccccc21,CC#N,279.0
CN1c2ccccc2CCc2ccccc21,CO,278.0
CN1c2ccccc2Sc2c(C=Nc3ccc4ccccc4c3)cccc21,ClCCl,321.0
CN1c2ccccc2Sc2cc(C=Cc3ccc(N(c4ccc(C=Cc5ccc6c(c5)Sc5ccccc5N6C)cc4)c4ccc(C=Cc5ccc(C=Cc6ccc(N(c7ccc(C=Cc8ccc9c(c8)Sc8ccccc8N9C)cc7)c7ccc(C=Cc8ccc9c(c8)Sc8ccccc8N9C)cc7)cc6)c6nsnc56)cc4)cc3)ccc21,ClCCl,430.0
CN1c2ccccc2Sc2cc(C=Nc3ccc4c(c3)Cc3ccccc3-4)ccc21,ClCCl,405.0
CN1c2ccccc2Sc2cc(C=[N+]([O-])c3ccc(Br)cc3)ccc21,ClCCl,316.0
CN1c2ccccc2Sc2cc(C=[N+]([O-])c3ccc(Cl)cc3)ccc21,ClCCl,316.0
CN1c2ccccc2Sc2cc(C=[N+]([O-])c3cccc(Br)c3)ccc21,ClCCl,317.0
CN1c2ccccc2Sc2cc(N=Cc3ccc4c(c3)N(C)c3ccccc3S4)ccc21,ClCCl,403.0
CN1c2ccccc2Sc2cc(N=Cc3cccc4c3N(C)c3ccccc3S4)ccc21,ClCCl,403.0
CN1c2ccccc2Sc2cc(N=Cc3cccc4c3Sc3ccccc3N4C)ccc21,ClCCl,411.0
CN1c2ccccc2Sc2cc3ccccc3c(/C=C/c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)c21,C1CCOC1,443.0
CN1c2ccccc2Sc2cc3ccccc3c(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)c21,C1CCOC1,391.0
CN1c2ccccc2Sc2ccc(C=Nc3ccc4c(c3)Cc3ccccc3-4)cc21,ClCCl,285.0
CN1c2ccccc2Sc2ccc(C=Nc3ccc4ccccc4c3)cc21,ClCCl,287.0
CN1c2ccccc2Sc2cccc(C=Nc3ccc4c(c3)Cc3ccccc3-4)c21,ClCCl,302.0
CN1c2ccccc2Sc2cccc(C=Nc3ccc4ccccc4c3)c21,ClCCl,370.0
CNC(=O)[C@H](C)NC(=O)c1cccc2c1C#Cc1c(N)cccc1OCCCO2,CC#N,347.0
CNC(=O)[C@H](C)NC(=O)c1cccc2c1C#Cc1c(N)cccc1OCCCO2,ClCCl,345.0
CNC(=O)[C@H](C)NC(=O)c1cccc2c1C#Cc1c(NC(=O)[C@@H](NC(C)=O)C(C)C)cccc1OCCCO2,CC#N,324.0
CNC(=O)[C@H](C)NC(=O)c1cccc2c1C#Cc1c(NC(=O)[C@@H](NC(C)=O)C(C)C)cccc1OCCCO2,ClCCl,336.0
CNC(=O)c1c2ccccc2cc2ccccc12,CC#N,365.0
CNC(=O)c1ccc(-c2c3ccccc3nn2C)s1,CC#N,339.0
CNC(=O)c1ccc(-c2c3ccccc3nn2C)s1,ClCCl,343.0
CNC(C)Cc1ccc(I)cc1,O,485.6
CNC(C)Cc1ccccc1Cl,O,483.4
CNCCCC1c2ccccc2C=Cc2ccccc21,CC#N,293.0
CNCCCC1c2ccccc2C=Cc2ccccc21,CO,293.0
CNCCCC1c2ccccc2C=Cc2ccccc21,O,292.0
CNCCCN1c2ccccc2CCc2ccccc21,CC#N,276.0
CNCCCN1c2ccccc2CCc2ccccc21,CO,276.0
CNCCCN1c2ccccc2CCc2ccccc21,O,275.0
CNc1cc2nc3cc(Br)c(Br)cc3nc2cc1NC,CCO,443.0
CNc1cc2nc3cc(F)c(F)cc3nc2cc1NC,CCO,434.0
CNc1ccc(/C=C/C#N)cc1,C1CCCCC1,340.0
CNc1ccc(/C=C/C#N)cc1,C1CCOC1,355.0
CNc1ccc(/C=C/C#N)cc1,C1COCCO1,350.0
CNc1ccc(/C=C/C#N)cc1,CC#N,350.0
CNc1ccc(/C=C/C#N)cc1,CC(C)O,361.0
CNc1ccc(/C=C/C#N)cc1,CC1CCCCC1,337.0
CNc1ccc(/C=C/C#N)cc1,CCO,359.0
CNc1ccc(/C=C/C#N)cc1,CO,356.0
CNc1ccc(/C=C/C#N)cc1,ClC(Cl)Cl,346.0
CNc1ccc(/C=C/C#N)cc1,O,343.0
CNc1ccc(/C=C/C(=O)OC)cc1,O,347.28
CNc1ccc(O)cc1,O,388.0
CNc1ccc2c(-c3ccccc3C(=O)[O-])c3cc/c(=[NH+]\C)cc-3oc2c1,O,530.0
CNc1ccc2c(c1)-c1ccccc1C2=O,C1CCCCC1,389.0
CNc1ccc2c(c1)-c1ccccc1C2=O,CC#N,424.0
CNc1ccc2c(c1)-c1ccccc1C2=O,CCO,436.0
CNc1ccc2c(c1)-c1ccccc1C2=O,c1ccccc1,409.0
CNc1ccc2c(c1)C(=O)c1ccccc1-2,C1CCCCC1,474.0
CNc1ccc2c(c1)C(=O)c1ccccc1-2,CC#N,508.0
CNc1ccc2c(c1)C(=O)c1ccccc1-2,CCO,511.0
CNc1ccc2c(c1)C(=O)c1ccccc1-2,c1ccccc1,491.0
CNc1ccc2c3c(cccc13)C(=O)N(C(=O)OC)C2=O,CS(C)=O,449.0
CNc1ccc2nc3cc(Cl)c(Cl)cc3nc2c1,CCO,490.0
CNc1cccc2c1-c1ccccc1C2=O,C1CCCCC1,449.0
CNc1cccc2c1-c1ccccc1C2=O,CC#N,471.0
CNc1cccc2c1-c1ccccc1C2=O,CCO,477.0
CNc1cccc2c1-c1ccccc1C2=O,c1ccccc1,461.0
CNc1cccc2c1C(=O)c1ccccc1-2,C1CCCCC1,432.0
CNc1cccc2c1C(=O)c1ccccc1-2,CC#N,445.0
CNc1cccc2c1C(=O)c1ccccc1-2,CCO,448.0
CNc1cccc2c1C(=O)c1ccccc1-2,c1ccccc1,445.0
CNc1cccc2c1C(=O)c1ccccc1C2=O,C1CCC2CCCCC2C1,488.0
CNc1cccc2c1C(=O)c1ccccc1C2=O,C1CCCCC1,488.0
CNc1cccc2c1C(=O)c1ccccc1C2=O,CC#N,501.0
CNc1cccc2c1C(=O)c1ccccc1C2=O,CC1CCCCC1,489.0
CNc1cccc2c1C(=O)c1ccccc1C2=O,CCC(C)CC,487.0
CNc1cccc2c1C(=O)c1ccccc1C2=O,CCCCCC,487.0
CNc1cccc2c1C(=O)c1ccccc1C2=O,CCOC(C)=O,497.5
CNc1ccccc1,CCCCCC,260.0
CNc1nc2cc3c(C)c(C(N)=O)c(=O)oc3cc2n1Cc1ccc2c(c1)OCO2,CCO,355.0
CNc1ncc2nc(C#N)n(Cc3ccccc3)c2n1,C1COCCO1,342.0
CNc1ncc2nc(C#N)n(Cc3ccccc3)c2n1,CC#N,342.0
CNc1ncc2nc(C#N)n(Cc3ccccc3)c2n1,CO,342.0
CNc1ncc2nc(C#N)n(Cc3ccccc3)c2n1,ClCCl,341.0
CNc1ncnc2cc(-c3ccc(C#N)cc3)n3nc(-c4ccccc4)cc3c12,ClCCl,329.0
CNc1ncnc2cc(-c3ccc(C(F)(F)F)cc3)n3nc(-c4ccccc4)cc3c12,ClCCl,333.0
CNc1ncnc2cc(-c3ccc(N(C)C)cc3)n3nc(-c4ccc(N(C)C)cc4)cc3c12,CCOCC,337.0
CNc1ncnc2cc(-c3ccc(N(C)C)cc3)n3nc(-c4ccc(N(C)C)cc4)cc3c12,CN(C)C=O,348.0
CNc1ncnc2cc(-c3ccc(N(C)C)cc3)n3nc(-c4ccc(N(C)C)cc4)cc3c12,ClCCl,352.0
CNc1ncnc2cc(-c3ccc(N(C)C)cc3)n3nc(-c4ccccc4)cc3c12,ClCCl,367.0
CNc1ncnc2cc(-c3ccc(OC)cc3)n3nc(-c4ccccc4)cc3c12,ClCCl,324.0
CNc1ncnc2cc(-c3ccccc3)n3nc(-c4ccc(C#N)cc4)cc3c12,ClCCl,337.0
CNc1ncnc2cc(-c3ccccc3)n3nc(-c4ccc(C(F)(F)F)cc4)cc3c12,ClCCl,333.0
CNc1ncnc2cc(-c3ccccc3)n3nc(-c4ccc(OC)cc4)cc3c12,ClCCl,328.0
CNc1ncnc2cc(-c3ccccc3)n3nc(-c4ccccc4)cc3c12,ClCCl,330.0
CO,CCCCCC,177.0
COC(=O)/C(C#N)=C/c1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)OC)cc4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)OC)cc4)cc3)cc2)cc1,C1CCOC1,432.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,C1CCOC1,333.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,C1COCCO1,333.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CCO,335.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CCOC(C)=O,330.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CN(C)C=O,330.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CO,330.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CS(C)=O,330.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,Cc1ccccc1,347.0
COC(=O)/C(C#N)=C/c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,339.0
COC(=O)/C(C#N)=c1/cc/c(=c2/cc/c(=C(\C#N)C(=O)OC)s2)s1,Cc1ccccc1,550.0
COC(=O)/C(C#N)=c1\s/c(=c2/s/c(=C(/C#N)C(=O)OC)c3cc(-c4ccc(C(F)(F)F)cc4)sc23)c2sc(-c3ccc(C(F)(F)F)cc3)cc12,Cc1ccccc1,596.0
COC(=O)/C(C#N)=c1\s/c(=c2/s/c(=C(/C#N)C(=O)OC)c3cc(-c4ccc(F)cc4)sc23)c2sc(-c3ccc(F)cc3)cc12,Cc1ccccc1,602.0
COC(=O)/C(C#N)=c1\s/c(=c2/s/c(=C(/C#N)C(=O)OC)c3cc(-c4ccc(OC)cc4)sc23)c2sc(-c3ccc(OC)cc3)cc12,Cc1ccccc1,628.0
COC(=O)/C(C#N)=c1\s/c(=c2/s/c(=C(/C#N)C(=O)OC)c3cc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)sc23)c2sc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc12,Cc1ccccc1,630.0
COC(=O)/C(C#N)=c1\s/c(=c2/s/c(=C(/C#N)C(=O)OC)c3cc(-c4ccccc4)sc23)c2sc(-c3ccccc3)cc12,Cc1ccccc1,605.0
COC(=O)/C=C/C1=CC2=C(c3c(C)cc(C)cc3C)c3cc(/C=C/C(=O)OC)cn3[B-](F)(F)[N+]2=C1,ClCCl,577.0
COC(=O)/C=C/C1=CC2=C(c3c(C)cc(C)cc3C)c3cccn3[B-](F)(F)[N+]2=C1,ClCCl,537.0
COC(=O)/C=C/C=C/C1=[N+]2C(=C(c3c(C)cc(C)cc3C)c3ccc(/C=C/C=C/C(=O)OC)n3[B-]2(F)F)C=C1,ClCCl,641.0
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,C1CCOC1,372.0
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,C1COCCO1,371.5
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,C=CC#N,369.5
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,CC#N,370.5
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,CC(C)=O,369.0
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,CCCCCC,368.5
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,CCOC(C)=O,370.0
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,CO,370.6
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,Cc1ccccc1,374.5
COC(=O)/C=C/c1ccc2ccc3cccc4ccc1c2c34,ClCCl,372.5
COC(=O)/C=C/c1sc(-c2ccc(N(C)C)cc2)c(-c2ccc(OC)cc2)c1O,CC#N,451.0
COC(=O)/C=C/c1sc(-c2ccc(N(C)C)cc2)c(-c2cccnc2)c1N,CC#N,415.0
COC(=O)/C=C/c1sc(-c2ccc(N(C)C)cc2)cc1N,CC#N,419.0
COC(=O)/C=C/c1sc(-c2ccc(N(C)C)s2)c(-c2ccsc2)c1N,CC#N,472.0
COC(=O)/C=C/c1sc(-c2ccc(N(C)C)s2)c(-c2cn(C)c3ccccc23)c1O,CC#N,478.0
COC(=O)C(C#N)=CNc1cccc(F)c1,CS(C)=O,324.0
COC(=O)C(C)(C)C1Oc2ccc(Br)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,ClCCl,343.0
COC(=O)C(C)(C)C1Oc2ccc(C(C)C)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,ClCCl,368.0
COC(=O)C(C)(C)C1Oc2ccc(C)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,C1CCCCC1,364.0
COC(=O)C(C)(C)C1Oc2ccc(C)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,CC#N,380.0
COC(=O)C(C)(C)C1Oc2ccc(C)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,ClCCl,367.0
COC(=O)C(C)(C)C1Oc2ccc(C)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(OC)cc1,ClCCl,367.0
COC(=O)C(C)(C)C1Oc2ccc(Cl)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,ClCCl,367.0
COC(=O)C(C)(C)C1Oc2ccc(F)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,ClCCl,367.0
COC(=O)C(C)(C)C1Oc2ccc(F)cc2C(=O)/C1=C\O,ClCCl,364.0
COC(=O)C(C)(C)C1Oc2ccc(OC)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,ClCCl,390.0
COC(=O)C(C)(C)C1Oc2ccc(OC)cc2C(=O)/C1=C\NS(=O)(=O)c1ccc(OC)cc1,ClCCl,392.0
COC(=O)C(C)(C)C1Oc2ccc(OC)cc2C(=O)/C1=C\O,ClCCl,383.0
COC(=O)C(C)(C)C1Oc2ccccc2C(=O)/C1=C\NS(=O)(=O)c1ccc(C)cc1,ClCCl,358.0
COC(=O)C(C)(C)C1Oc2ccccc2C(=O)/C1=C\NS(=O)(=O)c1ccc(OC)cc1,ClCCl,358.0
COC(=O)C(C)(C)C1Oc2ccccc2C(=O)/C1=C\O,ClCCl,362.0
COC(=O)C(C)NC(=O)CCNc1cccc2ccccc12,CCO,331.0
COC(=O)C(CCCCNC(=O)CCNc1cccc2ccccc12)NC(C)=O,CCO,330.0
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,C1CCCCC1,383.5002838
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,C1CCOC1,385.5005532
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,C1COCCO1,386.5003169
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CC#N,385.000385
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CC(C)=O,384.8003848
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CC(C)CC(C)(C)C,382.4998661
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CC(C)O,384.5000346
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CC(O)CO,386.7005932
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CC1CCCCC1,383.5002838
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CC1COC(=O)O1,386.9998994
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CCCCCC,382.6506209
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CCCCCO,385.5005532
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CCCCO,385.3742755
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CCO,384.7500471
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CCOC(C)=O,384.5000346
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CN(C)C=O,387.4992734
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CNC=O,386.5003169
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CO,383.9995085
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CS(C)=O,389.0006185
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,ClC(Cl)(Cl)Cl,386.3748764
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,ClC(Cl)Cl,386.9744403
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,ClCCl,386.5242196
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,N#Cc1ccccc1,389.0006185
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,NC=O,388.5003885
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,O,386.0005327
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,OC(C(F)(F)F)C(F)(F)F,385.0997216
COC(=O)C(Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,OCC(F)(F)F,382.4998661
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCCCC1,339.99728
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCOC1,341.7985439
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,C1COCCO1,341.4017958
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CC#N,339.99728
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)(C)O,341.7985439
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)=O,340.7038942
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CC(C)(C)C,339.9048266
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)O,340.4834866
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(O)CO,342.3016362
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1CCCO1,341.4134517
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCO,342.5009419
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCO,342.5948131
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCO,340.7967829
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCO,341.7985439
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CCO,340.4834866
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOC(C)=O,340.0204012
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOCC,339.6047001
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CN(C)C=O,342.1142662
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CO,339.6969903
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,CS(C)=O,343.5953821
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1,342.6065506
COC(=O)C(Cc1ccc2oc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1)NC(=O)OC(C)(C)C,OCCO,343.2062326
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCCCC1,335.0981838
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCOC1,341.7985439
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,C1COCCO1,340.7967829
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC#N,343.394801
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)=O,343.1002539
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CC(C)(C)C,333.000333
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CO,344.4949704
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)O,343.9026068
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)OC(C)C,339.5009336
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(O)CO,349.5037047
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1CCCO1,338.9026333
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1COC(=O)O1,345.1012872
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCC(C)CC,333.000333
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCC,332.9005626
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCC,333.6002135
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCC,334.8961822
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCCC,334.8961822
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCO,345.697791
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCO,345.6022119
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCO,342.7004798
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCO,345.9010723
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCO,346.5964231
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOC(C)=O,339.6969903
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOCC,338.2034632
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CN(C)C=O,346.5003465
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CO,346.5003465
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,COCCOC,343.9026068
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,CS(C)=O,348.5049139
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1,341.997264
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1C,341.4017958
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,ClC(Cl)Cl,344.6018126
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,ClCCl,344.4949704
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,NC=O,349.4060098
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,OC1CCCCC1,346.5003465
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,OCCO,351.9020305
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)C)cc3)nc2c1)NC(=O)OC(C)(C)C,c1ccccc1,342.9943406
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCCCC1,342.5009419
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCOC1,348.1045706
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1COCCO1,348.2985615
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC#N,347.1981112
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)=O,348.894006
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CC(C)(C)C,340.7967829
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CO,350.2995061
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)O,348.894006
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(O)CO,353.9948317
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1CCCO1,347.2945753
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1COC(=O)O1,350.5942573
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCC(C)CC,339.99728
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCC,339.6047001
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCC,340.9013432
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCC,341.7985439
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCCC,341.7985439
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCO,351.0989397
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCO,351.2962833
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCO,347.5963711
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCO,351.2962833
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCO,350.4959518
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOC(C)=O,345.697791
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOCC,344.1985337
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CN(C)C=O,352.0011264
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CO,350.2013658
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,COCCOC,349.4060098
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CS(C)=O,354.4967918
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1,349.0035947
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1C,349.1985892
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,ClC(Cl)Cl,352.2987493
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,ClCCl,350.5942573
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,NC=O,355.0001775
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,OC1CCCCC1,352.2987493
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,OCCO,355.6946717
COC(=O)C(Cc1ccc2oc(-c3ccc(N(C)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,c1ccccc1,349.8950315
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCCCC1,361.7002807
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCOC1,362.8499688
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1COCCO1,363.1002956
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC#N,360.4993637
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)=O,360.4499858
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)O,365.4503262
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(O)CO,368.3499029
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1CCCCC1,361.3500036
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1COC(=O)O1,361.4505734
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCC,359.8002389
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCC,361.5498921
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCO,367.7498124
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCO,367.100457
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCO,366.3003663
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOC(C)=O,360.5006633
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CN(C)C=O,363.0001234
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CO,365.0501031
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,COCCOC,362.5500319
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CS(C)=O,364.000364
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,ClC(Cl)Cl,369.2503111
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,ClCCl,366.1756252
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,N#Cc1ccccc1,368.2997076
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,NC=O,367.4498247
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,O,367.0007597
COC(=O)C(Cc1ccc2oc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,OCC(F)(F)F,366.1005532
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCCCC1,341.2037669
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1CCOC1,350.9018177
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,C1COCCO1,347.3548925
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC#N,346.4043231
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)=O,348.5049139
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CC(C)(C)C,338.9026333
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CO,357.8969972
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)O,355.5049948
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)OC(C)C,350.0052501
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC(O)CO,355.7959155
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1CCCO1,348.1045706
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CC1COC(=O)O1,353.8946102
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCC(C)CC,339.3051031
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCC,338.9026333
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCC,338.9026333
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCC,340.2981011
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCCC,339.99728
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCO,359.5053207
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCO,359.1954023
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCO,355.4039166
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCCCO,357.9226171
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCO,356.2014676
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOC(C)=O,346.5964231
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CCOCC,346.4043231
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CN(C)C=O,354.195445
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CO,353.5067873
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,COCCOC,351.9020305
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,CS(C)=O,357.8969972
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1,346.5964231
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1C,346.4043231
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,ClC(Cl)Cl,347.1981112
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,ClCCl,345.6022119
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,NC=O,355.7959155
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,OC1CCCCC1,357.1045959
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,OCCO,357.8969972
COC(=O)C(Cc1ccc2oc(-c3ccc(Nc4ccccc4)cc3)nc2c1)NC(=O)OC(C)(C)C,c1ccccc1,346.8970063
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,C1CCCCC1,325.99837
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,C1CCOC1,327.2893893
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,C1COCCO1,327.3001015
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC#N,325.9027506
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)=O,325.9027506
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CC(C)(C)C,325.0975293
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)CO,335.7958361
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)O,327.0004251
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC(C)OC(C)C,327.3965427
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC(O)CO,337.9977016
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC1CCCO1,326.9042171
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CC1COC(=O)O1,325.99837
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCC(C)CC,324.4014793
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCC,324.4962196
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCC,325.2984613
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCC,325.99837
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCCCC,326.2004175
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCCO,328.2994091
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCCO,328.2024353
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCCO,327.3001015
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCCCO,327.3965427
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCO,334.694424
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCOC(C)=O,325.5950249
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CCOCC,325.2984613
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CN(C)C=O,327.901105
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CO,334.2022592
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,COCCOC,326.7973856
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,CS(C)=O,332.6016098
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1,328.9040916
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,Cc1ccccc1C,329.0989271
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,ClC(Cl)Cl,329.6956909
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,ClCCl,328.7959492
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,NC=O,327.6969459
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,OC1CCCCC1,328.6014721
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,OCCO,338.9026333
COC(=O)C(Cc1ccc2oc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)nc2c1)NC(=O)OC(C)(C)C,c1ccccc1,328.7959492
COC(=O)C(Cc1ccc2oc(-c3ccncc3)nc2c1)NC(=O)OC(C)(C)C,CC#N,302.8571429
COC(=O)C(Cc1ccc2oc(-c3ccncc3)nc2c1)NC(=O)OC(C)(C)C,CC1CCCCC1,307.1227364
COC(=O)C(Cc1ccc2oc(-c3ccncc3)nc2c1)NC(=O)OC(C)(C)C,CO,306.0764588
COC(=O)C(N)Cc1ccc(O[Si]2(Oc3ccc(CC(N)C(=O)OC)cc3)n3c4c5ccccc5c3/N=C3\N=C(/N=c5/c6ccccc6/c(n52)=N/C2=N/C(=N\4)c4ccccc42)c2ccccc23)cc1,CN(C)C=O,680.0
COC(=O)C(NC(=O)CCNc1cccc2ccccc12)C(C)C,CCO,330.0
COC(=O)C(NC(=O)CCNc1cccc2ccccc12)c1ccccc1,CCO,330.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)nc2c1,CC#N,308.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)nc2c1,CC1CCCCC1,328.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)nc2c1,CO,309.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)c(OC)c(OC)c3)nc2c1,CC#N,312.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)c(OC)c(OC)c3)nc2c1,CC1CCCCC1,327.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)c(OC)c(OC)c3)nc2c1,CO,313.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)c(OC)cc3OC)nc2c1,CC#N,333.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)c(OC)cc3OC)nc2c1,CC1CCCCC1,327.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)c(OC)cc3OC)nc2c1,CO,335.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)ccc3OC)nc2c1,CC#N,333.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)ccc3OC)nc2c1,CC1CCCCC1,332.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cc(OC)ccc3OC)nc2c1,CO,337.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(C#N)cc3)nc2c1,CC#N,333.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(C#N)cc3)nc2c1,CC1CCCCC1,337.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(C#N)cc3)nc2c1,CO,317.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(F)cc3)nc2c1,CC#N,314.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(F)cc3)nc2c1,CC1CCCCC1,317.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(F)cc3)nc2c1,CO,302.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(N(C)C)cc3OC)nc2c1,CC#N,343.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(N(C)C)cc3OC)nc2c1,CC1CCCCC1,336.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(N(C)C)cc3OC)nc2c1,CO,346.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(O)cc3O)nc2c1,CC#N,320.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(O)cc3O)nc2c1,CC1CCCCC1,336.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(O)cc3O)nc2c1,CO,321.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(OC(=O)c4ccccc4)cc3OC(=O)c3ccccc3)nc2c1,CC#N,306.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(OC(=O)c4ccccc4)cc3OC(=O)c3ccccc3)nc2c1,CC1CCCCC1,323.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3ccc(OC(=O)c4ccccc4)cc3OC(=O)c3ccccc3)nc2c1,CO,306.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cccc(Oc4ccccc4)c3)nc2c1,CC#N,305.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cccc(Oc4ccccc4)c3)nc2c1,CC1CCCCC1,321.0
COC(=O)C(NC(=O)OC(C)(C)C)c1ccc2oc(-c3cccc(Oc4ccccc4)c3)nc2c1,CO,305.0
COC(=O)C(c1ccccc1)=[N+]([O-])c1ccccc1,ClCCl,618.0
COC(=O)C1(C(=O)OC)Cc2c(C#Cc3ccc(OC)cc3)c(-c3ccc(OC)cc3)c3c(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c(-c4ccccc4)c3c2C1,C1CCOC1,348.891129
COC(=O)C1=C(C(=O)OC)C2(c3cc(Cl)ccc3-c3c(Cl)cc(Cl)cc32)C2(/C=C/c3ccccc3)c3cc(OC)c(OC)cc3CCN12,ClCCl,327.0
COC(=O)C1=C(C(=O)OC)C2(c3cc([N+](=O)[O-])ccc3-c3ccc([N+](=O)[O-])cc32)C2(/C=C/c3ccccc3)c3cc(OC)c(OC)cc3CCN12,ClCCl,337.0
COC(=O)C1=C(C(=O)OC)C2(c3ccccc3-c3c(Br)cc(Br)cc32)C2(/C=C/c3ccc(Cl)cc3)c3cc(OC)c(OC)cc3CCN12,ClCCl,328.0
COC(=O)C1=C(C(=O)OC)C2(c3ccccc3-c3c(Br)cc(Br)cc32)C2(/C=C/c3ccccc3)c3cc(OC)c(OC)cc3CCN12,ClCCl,328.0
COC(=O)C1=C(C(=O)OC)C2(c3ccccc3-c3c(C(=O)OC)cccc32)[C@@H](c2ccc(Cl)cc2)C=C2c3cc(OC)c(OC)cc3CCN21,ClCCl,311.0
COC(=O)C1=C(C(=O)OC)C2(c3ccccc3-c3ccc([N+](=O)[O-])cc32)C2(/C=C/c3ccccc3)c3cc(OC)c(OC)cc3CCN12,ClCCl,333.0
COC(=O)C1=C(C(=O)OC)C2(c3ccccc3-c3ccccc32)[C@@H](c2ccc(C)cc2)C=C2c3cc(OC)c(OC)cc3CCN21,ClCCl,311.0
COC(=O)C1=C(C(=O)OC)C2(c3ccccc3-c3ccccc32)[C@@H](c2ccccc2)C=C2c3cc(OC)c(OC)cc3CCN21,ClCCl,311.0
COC(=O)C1=C(C(=O)OC)C2=C[C@H]3c4ccccc4[C@]2([Se]1)c1ccccc13,ClCCl,370.0
COC(=O)C1=C(C(=O)OC)[Se](=O)[C@]23C1=C[C@H](c1ccccc12)c1ccccc13,ClCCl,341.0
COC(=O)C1=C(C(N)=O)N2N=Cc3ccccc3C2C1C(=O)OC,CCO,487.0
COC(=O)C1=C(C)NC2=C(C(=O)C(C)(C)CC2)C1c1cccc(Cl)c1,CO,362.0
COC(=O)C1=C(C)NC2=C(C(=O)C(C)(C)CC2)C1c1cccc(Cl)c1Cl,CO,367.0
COC(=O)C1=C(C)NC2=C(C(=O)C(C)(C)CC2)C1c1ccccc1Cl,CO,367.0
COC(=O)C1=C2C=CC=NN2C(C(=O)OC)C1,C1CCCCC1,496.0
COC(=O)CC1(C(=O)O)Oc2c(c(C(C)=O)c3c(c2C(C)=O)OCO3)O1,CC#N,434.0
COC(=O)CC1(C(=O)OC)Oc2c(c(C(C)=O)c3c(c2C(C)=O)OCO3)O1,CC#N,423.0
COC(=O)CCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,428.0
COC(=O)CCC(NC(=O)CCNc1cccc2ccccc12)C(=O)OC,CCO,330.0
COC(=O)CCC1=CC(C#Cc2cccs2)=[N+]2C1=Cc1c(CCC(=O)OC)cc(C#Cc3cccs3)n1[B-]2(F)F,ClCCl,649.0
COC(=O)CCN(CCNc1ccc2c3c(cccc13)C(=O)N(CCN(CCC(=O)OC)CCC(=O)OC)C2=O)CCC(=O)OC,ClC(Cl)Cl,450.0
COC(=O)CCN(CCNc1ccc2c3n(c(=O)c4cccc1c42)CCN=3)CCC(=O)OC,ClC(Cl)Cl,432.0
COC(=O)CCNC(=O)OCc1cc(=O)oc2c1cc(OC)c1ccccc12,CCO,374.0
COC(=O)CN1C(=O)C(=Cc2ccc(N(C)C)cc2)N=C1C,CO,436.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,C1CCOC1,373.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,C1COCCO1,372.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,CC#N,380.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,CC(C)=O,375.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,CC(C)O,385.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,CCO,379.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,CN(C)C=O,380.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,CO,382.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,Cc1ccccc1,373.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,ClC(Cl)Cl,380.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,ClCCl,379.0
COC(=O)CN1C(=O)c2cc3ccc(N(C)C)cc3cc2C1=O,O,388.0
COC(=O)CN1C(=O)c2cccc3c(N4CCOCC4)ccc(c23)C1=O,CS(C)=O,399.0
COC(=O)CN1C(=O)c2cccc3c(NCc4ccccc4)ccc(c23)C1=O,CS(C)=O,439.0
COC(=O)CNC(=O)CCNc1cccc2ccccc12,CCO,330.0
COC(=O)CNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,C1COCCO1,336.0
COC(=O)CNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,CC#N,336.0
COC(=O)CNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,CO,340.0
COC(=O)CNC(=O)c1nc2c(N(C)C)nc(N(C)C)nc2n1Cc1ccccc1,ClCCl,343.0
COC(=O)CNc1c(/C=C/c2ccc(OC)cc2)nc2cc(C(=O)OC)ccn12,CS(C)=O,411.0
COC(=O)COc1ccc(/C=C/C2=[N+]3C(=C(c4ccc(N5CCCCC5)cc4)c4c(C)cc(C)n4[B-]3(F)F)C(C)=C2)cc1,CO,567.0
COC(=O)COc1ccc(/C=C/C2=[N+]3C(=C(c4ccccc4)c4c(C)cc(C)n4[B-]3(F)F)C(C)=C2)cc1,CO,562.0
COC(=O)COc1nc(-c2ccc3ccc4cccnc4c3n2)sc1C,CC#N,234.0
COC(=O)COc1nc(-c2cccc(-c3ccccn3)n2)sc1C,CC#N,237.0
COC(=O)C[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@@H](CC1=CCc2ccccc21)C(=O)OC)NC(=O)OC(C)(C)C,CC#N,280.0
COC(=O)C[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@@H](CC1=CCc2ccccc21)C(=O)OC)NC(=O)OC(C)(C)C,CCOC(C)=O,280.0
COC(=O)C[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)N[C@@H](CC1=CCc2ccccc21)C(=O)OC)NC(=O)OC(C)(C)C,CO,280.0
COC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)OC,CC#N,280.0
COC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)OC,CCOC(C)=O,280.0
COC(=O)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)OC,CO,280.0
COC(=O)[C@@H]1C(=O)Oc2ccccc2[C@H]1c1c[nH]c2ccccc12,CS(C)=O,284.0
COC(=O)[C@@H]1CCCN1C(=CC(=C1C(=O)N(S(=O)(=O)c2ccc(C)cc2)c2ccccc21)c1ccccc1)c1ccc(C(C)(C)C)cc1,ClCCl,482.0
COC(=O)[C@H](CO)NC(=O)OC(C)(C)C,CN(C)C=O,350.0
COC(=O)[C@H](Cc1ccc2oc(-c3c4ccccc4cc4ccccc34)nc2c1)NC(=O)OC(C)(C)C,CO,508.0
COC(=O)[C@H](Cc1ccc2oc(-c3ccc(C)cc3)nc2c1)NC(=O)OC(C)(C)C,CO,342.0
COC(=O)[C@H](Cc1ccc2oc(-c3ccc4ccc5cccc6ccc3c4c56)nc2c1)NC(=O)OC(C)(C)C,CO,428.0
COC(=O)[C@H](Cc1ccc2oc3c(c2c1)=CC1=C(c2ccc(OC)cc2)c2cc4c5cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)OC)ccc5oc4n2[B-](F)(F)[N+]=31)NC(=O)OC(C)(C)C,C1CCCCC1,586.5
COC(=O)[C@H](Cc1ccc2oc3c(c2c1)=CC1=C(c2ccc(OC)cc2)c2cc4c5cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)OC)ccc5oc4n2[B-](F)(F)[N+]=31)NC(=O)OC(C)(C)C,CCOC(C)=O,581.5
COC(=O)[C@H](Cc1ccc2oc3c(c2c1)=CC1=C(c2ccc(OC)cc2)c2cc4c5cc(C[C@H](NC(=O)OC(C)(C)C)C(=O)OC)ccc5oc4n2[B-](F)(F)[N+]=31)NC(=O)OC(C)(C)C,CO,580.0
COC(=O)[C@H](Cc1ccccc1)Nc1c(C(C)=O)c(=O)oc2cc(N(C)C)ccc12,ClCCl,373.0
COC(=O)c1[nH]c(-c2ccc(Br)cc2)c2nnc3ccc(OC)cc3c12,ClCCl,395.0
COC(=O)c1[nH]c(-c2ccc([N+](=O)[O-])cc2)c2nnc3ccc(OC)cc3c12,ClCCl,436.0
COC(=O)c1[nH]c(-c2ccccc2)c2nnc3c4ccccc4oc3c12,ClCCl,403.0
COC(=O)c1[nH]c(-c2ccccc2)c2nnc3ccc(OC)cc3c12,ClCCl,392.0
COC(=O)c1[nH]c(-c2ccccc2)c2nnc3ccsc3c12,ClCCl,401.0
COC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2ccc(Br)cc2)c1C(=O)OC,ClCCl,325.0
COC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2cccc(C)c2)c1C(=O)OC,ClCCl,324.0
COC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2cccc(Cl)c2)c1C(=O)OC,ClCCl,273.0
COC(=O)c1c(-c2cc3ccccc3oc2=O)nn(-c2cccc(F)c2)c1C(=O)OC,ClCCl,323.0
COC(=O)c1c(C(=O)OC)c(C(=O)OC)c(C(=O)OC)c(C(=O)OC)c1C(=O)OC,CC#N,526.0
COC(=O)c1c(C(=O)OC)c2cc(C)ccn2c1-c1nc(C#N)c(C#N)nc1-c1ccccc1,C1CCOC1,452.0
COC(=O)c1c(C(=O)OC)c2ccc(-c3ccc(Br)cc3)nn2c1C(=O)OC,CC#N,350.0
COC(=O)c1c(C(=O)OC)c2ccc(-c3ccc(F)cc3)nn2c1C(=O)OC,CO,449.0
COC(=O)c1c(C(=O)OC)c2ccc(-c3ccc4ccccc4c3)nn2c1C(=O)OC,CO,450.0
COC(=O)c1c(C(=O)OC)c2ccc(C#Cc3ccccc3)nn2c1C(=O)OC,CS(C)=O,467.0
COC(=O)c1c(C(=O)OC)c2ccc(C)nn2c1C,C1CCCCC1,380.4
COC(=O)c1c(C(=O)OC)c2ccc(C=Cc3c4ccccc4cc4ccccc34)nn2c1C(=O)OC,CCCCCC,510.0
COC(=O)c1c(C(=O)OC)c2ccc(C=Cc3ccc(-c4ccccc4)cc3)nn2c1C(=O)OC,CO,455.0
COC(=O)c1c(C(=O)OC)c2ccc(C=Cc3ccc(C)cc3)nn2c1C(=O)OC,CCCCCC,452.0
COC(=O)c1c(C(=O)OC)c2ccc(C=Cc3ccc(F)cc3)nn2c1C(=O)OC,CO,454.0
COC(=O)c1c(C(=O)OC)c2ccc(C=Cc3ccc(OC)cc3)nn2c1C(=O)OC,CO,466.0
COC(=O)c1c(C(=O)OC)c2ccc(C=Cc3ccc4ccccc4c3)nn2c1C(=O)OC,CO,460.0
COC(=O)c1c(C(=O)OC)c2ccc(C=Cc3cccc4ccccc34)nn2c1C(=O)OC,CO,453.0
COC(=O)c1c(C(=O)OC)c2ccccn2c1-c1nc(C#N)c(C#N)nc1-c1ccccc1,C1CCOC1,440.0
COC(=O)c1c(C(=O)OC)c2cccnn2c1C(=O)c1ccc(C)cc1,C1CCCCC1,451.0
COC(=O)c1c(C(=O)OC)c2cccnn2c1C(=O)c1ccc(Cl)cc1,C1CCCCC1,448.0
COC(=O)c1c(C)nn(-c2nc3ccccc3s2)c1-c1ccccc1O,CS(C)=O,292.0
COC(=O)c1c(C)sc2c1N(C)C1(C=Cc3c(ccc4ccccc34)O1)C2(C)C,Cc1ccccc1,564.0
COC(=O)c1c(C=Cc2ccc(C=Cc3cc(OC)c(OC)c(OC)c3)cc2)oc2cc3c(C(=O)OC)c(C=Cc4ccc(C=Cc5cc(OC)c(OC)c(OC)c5)cc4)oc3cc12,ClCCl,451.0
COC(=O)c1c(C=Cc2ccc(C=Cc3ccc(C(F)(F)F)cc3)cc2)oc2cc3c(C(=O)OC)c(C=Cc4ccc(C=Cc5ccc(C(F)(F)F)cc5)cc4)oc3cc12,ClCCl,446.0
COC(=O)c1c(C=Cc2ccc(C=Cc3ccc(Cl)cc3)cc2)oc2cc3c(C(=O)OC)c(C=Cc4ccc(C=Cc5ccc(Cl)cc5)cc4)oc3cc12,ClCCl,446.0
COC(=O)c1c(C=Cc2ccc(C=Cc3ccc(F)cc3)cc2)oc2cc3c(C(=O)OC)c(C=Cc4ccc(C=Cc5ccc(F)cc5)cc4)oc3cc12,ClCCl,445.0
COC(=O)c1c(C=Cc2ccc(C=Cc3ccc(OC)cc3)cc2)oc2cc3c(C(=O)OC)c(C=Cc4ccc(C=Cc5ccc(OC)cc5)cc4)oc3cc12,ClCCl,450.0
COC(=O)c1c(C=Cc2ccc(C=Cc3ccc(SC)cc3)cc2)oc2cc3c(C(=O)OC)c(C=Cc4ccc(C=Cc5ccc(SC)cc5)cc4)oc3cc12,ClCCl,452.0
COC(=O)c1c(C=Cc2ccc(C=Cc3ccccc3)cc2)oc2cc3c(C(=O)OC)c(C=Cc4ccc(C=Cc5ccccc5)cc4)oc3cc12,ClCCl,445.0
COC(=O)c1c(NC(C)(C)C)oc(-c2ccc(-c3ccccc3)cc2)c1C(=O)OC,CC#N,355.0
COC(=O)c1c(NC(C)(C)C)oc(-c2ccccc2)c1C(=O)OC,CC#N,334.0
COC(=O)c1c2c(cc3ccc(N(C)C)cc13)CCC2,ClCCl,378.0
COC(=O)c1c2ccccc2nc2ccccc12,C1CCOC1,361.0
COC(=O)c1c2ccccc2nc2ccccc12,C1COCCO1,361.0
COC(=O)c1c2ccccc2nc2ccccc12,CC#N,360.0
COC(=O)c1c2ccccc2nc2ccccc12,CCCCCO,361.0
COC(=O)c1c2ccccc2nc2ccccc12,CCCCO,360.0
COC(=O)c1c2ccccc2nc2ccccc12,CCCO,361.0
COC(=O)c1c2ccccc2nc2ccccc12,CCO,360.0
COC(=O)c1c2ccccc2nc2ccccc12,CO,360.0
COC(=O)c1c2ccccc2nc2ccccc12,COCCOC,361.0
COC(=O)c1c2ccccc2nc2ccccc12,ClC(Cl)Cl,361.0
COC(=O)c1c2ccccc2nc2ccccc12,ClCCl,361.0
COC(=O)c1c2ccccc2nc2ccccc12,OCCO,361.0
COC(=O)c1cc(/C=C/c2ccc(F)cc2)n2ccc3ccccc3c12,ClCCl,365.0
COC(=O)c1cc(/C=C/c2ccccc2)n2ccc3ccccc3c12,ClCCl,367.0
COC(=O)c1cc(/C=C/c2ccccc2)n2ccccc12,ClCCl,368.0
COC(=O)c1cc(/N=N/c2cc3c4c(c2)CCCN4CCC3)cc(C(=O)OC)c1,CCOC(C)=O,471.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,C1CCOC1,430.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,CC#N,448.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,CCO,458.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,CN(C)C=O,456.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,CO,456.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,CS(C)=O,460.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,Cc1ccccc1,442.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,ClC(Cl)Cl,454.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cc4c5c(c3)CCCN5CCC4)sc12,ClCCl,454.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccc(Oc4ccccc4)cc3)sc12,CC#N,396.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccc(Oc4ccccc4)cc3)sc12,ClCCl,398.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccc4c(c3)OCCO4)sc12,CC#N,398.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccc4c(c3)OCCO4)sc12,ClCCl,402.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccc4c(c3)OCO4)sc12,CC#N,400.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccc4c(c3)OCO4)sc12,ClCCl,404.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cccc(N(C)C)c3)sc12,CC#N,396.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cccc(N(C)C)c3)sc12,ClCCl,396.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cccc(OC)c3)sc12,CC#N,394.0
COC(=O)c1cc(=O)n(C)c2cc(-c3cccc(OC)c3)sc12,ClCCl,394.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccccc3)sc12,CC#N,392.0
COC(=O)c1cc(=O)n(C)c2cc(-c3ccccc3)sc12,ClCCl,394.0
COC(=O)c1cc(=O)n(Cc2ccccc2)c2cc(-c3ccc(N(C)C)cc3)sc12,CC#N,432.0
COC(=O)c1cc(=O)n(Cc2ccccc2)c2cc(-c3ccc(N(C)C)cc3)sc12,ClCCl,436.0
COC(=O)c1cc(=O)n(Cc2ccccc2)c2cc(-c3ccc(OC)cc3)sc12,CC#N,400.0
COC(=O)c1cc(=O)n(Cc2ccccc2)c2cc(-c3ccc(OC)cc3)sc12,ClCCl,404.0
COC(=O)c1cc(Br)ccc1N,O,410.0
COC(=O)c1cc(C#N)c(-c2cn3ccc[n+]3[n-]2)c(C#N)c1,ClCCl,466.0
COC(=O)c1cc(C(=O)OC)n2nc(-c3ccc(Br)cc3)ccc12,CC#N,355.0
COC(=O)c1cc(C(=O)OC)n2nc(-c3ccc(Cl)cc3)ccc12,CC#N,356.0
COC(=O)c1cc(C(=O)OC)n2ncc3ccccc3c12,C1CCCCC1,446.0
COC(=O)c1cc(C(=O)OC)n2ncccc12,C1CCCCC1,430.0
COC(=O)c1cc(N2CCC2)ccc1N1CCC1,ClCCl,375.0
COC(=O)c1cc(O)n(-c2cc(C)c3c(O)n[nH]c3n2)n1,C1CCOC1,296.0
COC(=O)c1cc(OC)cc(OC)c1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,569.0
COC(=O)c1cc(OC)ccc1OC,CO,318.0
COC(=O)c1cc(OCCCCCCn2c(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2/C=C(\C#N)C(=O)O)cc(OCCCCCCn2c(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2/C=C(\C#N)C(=O)O)c1,ClCCl,504.0
COC(=O)c1cc2c(-c3ccccc3)c(-c3ccccc3)c3cc(C(C)(C)C)cc4c(-c5ccccc5)c(-c5ccccc5)c(c1)c2[n+]34,ClCCl,354.0
COC(=O)c1cc2c3c([n+]4c(-c5ccccc5)c(-c5ccccc5)c5ccccc5c4c(-c4ccccc4)c3c1)OC(c1ccccc1)=C2c1ccccc1,ClCCl,534.0
COC(=O)c1cc2c3c([o+]c(-c4ccccc4)c(-c4ccccc4)c3c1)N1C(c3ccccc3)=C(c3ccccc3)c3ccccc3C1=C2c1ccccc1,ClCCl,534.0
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3c(C)cc(C)cc3[nH]2)n1,ClC(Cl)Cl,383.49
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3cc(Br)ccc3[nH]2)n1,ClC(Cl)Cl,387.86
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3cc(C(=O)c4ccccc4)ccc3[nH]2)n1,ClC(Cl)Cl,387.99
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3cc(C)ccc3[nH]2)n1,ClC(Cl)Cl,383.76
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3cc(Cl)ccc3[nH]2)n1,ClC(Cl)Cl,387.19
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3cc(F)ccc3[nH]2)n1,ClC(Cl)Cl,384.1
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3ccccc3[nH]2)n1,ClC(Cl)Cl,382.49
COC(=O)c1cc2c3ccccc3n(C)c2c(-c2nc3ccccc3o2)n1,ClC(Cl)Cl,370.51
COC(=O)c1cc2c3ccccc3n(Cc3ccccc3)c2c(-c2nc3ccccc3[nH]2)n1,ClC(Cl)Cl,376.7
COC(=O)c1cc2c3ccccc3n(Cc3ccccc3)c2c(-c2nc3ccccc3s2)n1,ClC(Cl)Cl,380.59
COC(=O)c1cc2nc3c4ccccc4c4ccccc4c3nc2cc1C(=O)OC,CN(C)C=O,402.0
COC(=O)c1ccc(-c2cc(-c3ccc(C(=O)OC)cc3)c3ccc4c(-c5ccc(C(=O)OC)cc5)cc(-c5ccc(C(=O)OC)cc5)c5ccc2c3c54)cc1,C1COCCO1,398.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,C1COCCO1,344.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CC#N,338.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CC(=O)N(C)C,341.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CCCCCCCCCCO,336.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CCCCCCCCO,334.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CCCCCCO,340.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CCCCO,337.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CCO,333.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,CS(C)=O,350.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,Cc1ccccc1,345.0
COC(=O)c1ccc(-c2ccc(-c3nnc(-c4ccc(-c5nnc(-c6ccc(-c7ccc(C(=O)OC)cc7)s6)o5)cc4)o3)s2)cc1,ClC(Cl)Cl,345.0
COC(=O)c1ccc(-c2ccc(/C=C/c3cc(C)c4n3[B-](F)(F)[N+]3=CC=CC3=C4)cc2)cc1,CS(C)=O,564.5
COC(=O)c1ccc(-c2ccc3c(c2)C(=O)c2cc(-c4ccc(C(=O)OC)cc4)ccc2-3)cc1,C1CCOC1,342.0
COC(=O)c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CC#N,363.0
COC(=O)c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CCCCO,375.0
COC(=O)c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CCO,375.0
COC(=O)c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CO,370.0
COC(=O)c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,Cc1ccccc1,361.0
COC(=O)c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,ClCCl,360.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,C1CCOC1,375.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CC#N,370.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CCCCO,382.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CCO,379.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CN(C)C=O,381.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,CO,376.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,Cc1ccccc1,366.0
COC(=O)c1ccc(-c2ccc3c(c2)[Si](c2ccccc2)(c2ccccc2)c2cc(-c4ccc(C(=O)OC)cc4)ccc2N3)cc1,ClCCl,367.0
COC(=O)c1ccc(-c2cn3ccc[n+]3[n-]2)c(C#N)c1,ClCCl,420.0
COC(=O)c1ccc(-c2cn3ccc[n+]3[n-]2)cc1,ClCCl,376.0
COC(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,C1CCCCC1,387.0
COC(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CC#N,392.0
COC(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CC(C)O,393.0
COC(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CO,396.0
COC(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,CS(C)=O,405.0
COC(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,ClC(Cl)Cl,395.0
COC(=O)c1ccc(-c2nc3ccc(N(C)C)cc3s2)cc1,c1ccccc1,394.0
COC(=O)c1ccc(/C=C/C(F)(F)F)c(N)c1,C1CCOC1,372.0
COC(=O)c1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,558.0
COC(=O)c1ccc(/C=C2\C=C(c3ccc(C#N)cc3)N(CC(C)C)C2=O)cc1,C1COCCO1,438.0
COC(=O)c1ccc(/C=C2\C=C(c3ccc(C#N)cc3)OC2=O)cc1,C1COCCO1,404.0
COC(=O)c1ccc(/C=C2\C=C(c3ccc(OC)c(OC)c3)OC2=O)cc1,C1COCCO1,423.0
COC(=O)c1ccc(/C=C2\C=C(c3ccc([N+](=O)[O-])cc3)N(CC(C)C)C2=O)cc1,C1COCCO1,442.0
COC(=O)c1ccc(/C=C2\C=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1,C1COCCO1,411.0
COC(=O)c1ccc(/C=C2\C=C(c3ccccc3)NC2=O)cc1,C1COCCO1,437.0
COC(=O)c1ccc(/C=C2\C=C(c3ccccc3)OC2=O)cc1,C1COCCO1,401.0
COC(=O)c1ccc(/C=C2\N=C(c3ccc(OC)c(OC)c3)NC2=O)cc1,C1COCCO1,403.0
COC(=O)c1ccc(/C=C2\N=C(c3ccc(OC)c(OC)c3)OC2=O)cc1,C1COCCO1,391.0
COC(=O)c1ccc(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)NC2=O)cc1,C1COCCO1,405.0
COC(=O)c1ccc(/C=C2\N=C(c3ccccc3)NC2=O)cc1,C1COCCO1,394.0
COC(=O)c1ccc(/C=C2\N=C(c3ccccc3)OC2=O)cc1,C1COCCO1,370.0
COC(=O)c1ccc(/N=N/c2cc3c4c(c2)CCCN4CCC3)cc1,CCOC(C)=O,474.0
COC(=O)c1ccc(C#Cc2c3c(c4c(-c5ccccc5)c(-c5ccccc5)c(-c5ccccc5)c(-c5ccccc5)c4c2-c2ccc(C(=O)OC)cc2)CC(C(=O)OC)(C(=O)OC)C3)cc1,C1CCOC1,347.3790323
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,C1CCCCC1,359.5053207
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,C1CCOC1,361.8861506
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,C1COCCO1,360.5032626
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CC#N,360.5032626
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CC(C)=O,362.0040544
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CC(C)CC(C)(C)C,364.4979041
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CC(C)O,360.5032626
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CC1CCCO1,354.4967918
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CCCCCCCCCCCCCCCC,365.497076
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CCCCCCCCCCCCCCCCCl,370.4938683
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CCOC(C)=O,357.0026061
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CCOCC,354.4967918
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CN(C)C=O,367.4984381
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CO,359.0019745
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,CS(C)=O,370.00037
COC(=O)c1ccc(C#Cc2ccc(N(C)C)cc2)cc1,Cc1ccccc1,369.4945315
COC(=O)c1ccc(C#Cc2ccccc2)cc1,C1CCCCC1,316.5959602
COC(=O)c1ccc(C#Cc2ccccc2)cc1,CC#N,311.6041381
COC(=O)c1ccc(C#Cc2ccccc2)cc1,CC(C)O,313.8042489
COC(=O)c1ccc(C#Cc2ccccc2)cc1,CCCCCC,314.8019895
COC(=O)c1ccc(C#Cc2ccccc2)cc1,CCCCCCCCCCCCCCCC,317.2991496
COC(=O)c1ccc(C#Cc2ccccc2)cc1,CCCCCCCCCCCCCCCCCl,317.1985028
COC(=O)c1ccc(C#Cc2ccccc2)cc1,CO,311.7984535
COC(=O)c1ccc(C(=O)OC)c(C(=O)OC)c1,CCOC(C)=O,311.0
COC(=O)c1ccc(C2=C(/C=C/c3ccc(OC)cc3)O[B-](F)(F)[O+]=C2/C=C/c2ccc(OC)cc2)cc1,ClCCl,507.0
COC(=O)c1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]cn4)cc(C)c32)cc1,ClC(Cl)Cl,572.0
COC(=O)c1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,C1CCCCC1,515.0
COC(=O)c1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,C1CCOC1,514.0
COC(=O)c1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,CC#N,511.0
COC(=O)c1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,CCOC(C)=O,512.0
COC(=O)c1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,CO,511.0
COC(=O)c1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,Cc1ccccc1,517.0
COC(=O)c1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,ClC(Cl)Cl,517.0
COC(=O)c1ccc(C2=C3C=c4sc(-c5cccs5)cc4=[N+]3[B-](F)(F)n3c2cc2sc(-c4cccs4)cc23)cc1,ClCCl,684.0
COC(=O)c1ccc(C2=C3C=c4sccc4=[N+]3[B-](F)(F)n3c2cc2sccc23)cc1,ClCCl,576.0
COC(=O)c1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,C1CCCCC1,318.0
COC(=O)c1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,C1CCOC1,324.0
COC(=O)c1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,CC#N,326.0
COC(=O)c1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,CCOCC,319.0
COC(=O)c1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,CC#N,390.0
COC(=O)c1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,CO,394.0
COC(=O)c1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,ClCCl,395.0
COC(=O)c1ccc(OCCCCCCn2c(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2/C=C(\C#N)C(=O)O)cc1,ClCCl,488.0
COC(=O)c1ccc(OCc2nnc(-c3ccn4c(C)nc(Cl)c4c3)o2)cc1,CC#N,386.0
COC(=O)c1ccc(Oc2ccc3c4c(cccc24)C(=O)N(c2c(C(C)C)cccc2C(C)C)C3=O)cc1,ClCCl,359.0
COC(=O)c1ccc2c(-c3ccccc3)c(-c3ccccc3)c3c4ccc(OC)cc4c(-c4ccccc4)c(-c4ccccc4)[n+]3c2c1,ClCCl,447.0
COC(=O)c1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3ccccc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,467.0
COC(=O)c1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)c1c3ccc(OC)cc3c(-c3ccccc3)c(-c3ccccc3)[n+]21,ClCCl,448.0
COC(=O)c1ccc2c(c1)c1cccc3c[n+](Cc4ccccc4)c2n31,CO,399.0
COC(=O)c1ccc2c(c1)c1cccc3cnc2n31,CO,420.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,C1COCCO1,470.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,CC#N,465.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,CC(C)=O,465.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,CC(C)O,476.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,CCCCO,476.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,CN(C)C=O,468.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,CO,465.0
COC(=O)c1ccc2c3ccc(C(=O)OC)c4c(C(=O)OC)ccc(c5ccc(C(=O)OC)c1c25)c43,ClC(Cl)Cl,469.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,C1CCOC1,379.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,CC#N,379.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,CCCCCC,379.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,CCO,380.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,CN(C)C=O,380.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,CO,379.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,Cc1ccccc1,381.0
COC(=O)c1ccc2ccc3cccc4ccc1c2c34,ClCCl,379.0
COC(=O)c1ccc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1C(=O)OC,CN(C)C=O,355.0
COC(=O)c1ccc2nc3c4ccccc4c4ccccc4c3nc2c1C(=O)OC,CN(C)C=O,404.0
COC(=O)c1ccc2oc3c(-c4ccccc4)c4c5ccccc5n(C)c4cc3c2c1,CCO,330.0
COC(=O)c1cccc(N)n1,CS(C)=O,326.0
COC(=O)c1cccc2c1C#Cc1c(N)cccc1OCCCO2,CC#N,359.0
COC(=O)c1cccc2c1C#Cc1c(N)cccc1OCCCO2,ClCCl,363.0
COC(=O)c1cccc2c1C#Cc1c(NC(C)=O)cccc1OCCCO2,CC#N,335.0
COC(=O)c1cccc2c1C#Cc1c(NC(C)=O)cccc1OCCCO2,ClCCl,341.0
COC(=O)c1ccccc1,CCO,280.2
COC(=O)c1ccccc1-c1c2ccc(=[N+](C)C)cc-2oc2c1ccc1cccc(O)c12,O,567.0
COC(=O)c1ccccc1-c1c2ccc(=[N+](C)C)cc-2oc2c1ccc1cccc(OC)c12,O,568.0
COC(=O)c1ccccc1-c1c2ccc(=[NH2+])cc-2oc2c1ccc1cccc(N)c12,O,576.0
COC(=O)c1ccccc1-c1c2ccc(=[NH2+])cc-2oc2c1ccc1cccc(O)c12,O,542.0
COC(=O)c1ccccc1-c1c2ccc(=[NH2+])cc-2oc2c1ccc1cccc(OC)c12,O,538.0
COC(=O)c1ccccc1-c1c2ccc(=[NH2+])cc-2oc2cc(N)ccc12,CC#N,500.0
COC(=O)c1ccccc1-c1c2ccc(=[NH2+])cc-2oc2cc(N)ccc12,CCO,506.0
COC(=O)c1ccccc1-c1c2ccc(=[NH2+])cc-2oc2cc(N)ccc12,CN(C)C=O,515.0
COC(=O)c1ccccc1-c1c2ccc(=[NH2+])cc-2oc2cc(N)ccc12,O,497.0
COC(=O)c1ccccc1C#Cc1ccccc1NC(C)=O,CC#N,330.0
COC(=O)c1ccccc1C#Cc1ccccc1NC(C)=O,ClCCl,334.0
COC(=O)c1ccccc1C(=O)OC,CCOC(C)=O,305.0
COC(=O)c1ccccc1C1=c2cc3c4c(c2Oc2c1ccc1cccc(N)c21)CCC[N+]=4CCC3,O,601.0
COC(=O)c1ccccc1C1=c2cc3c4c(c2Oc2c1ccc1cccc(O)c21)CCC[N+]=4CCC3,O,585.0
COC(=O)c1ccccc1C1=c2cc3c4c(c2Oc2c1ccc1cccc(OC)c21)CCC[N+]=4CCC3,O,582.0
COC(=O)c1ccn2c(N)c(-c3ccc(OC)cc3)nc2c1,CS(C)=O,426.0
COC(=O)c1ccn2c(NC(C)(C)C)c(/C=C/c3ccc(OC)cc3)nc2c1,CS(C)=O,416.0
COC(=O)c1ccn2c(NC(C)C)c(/C=C/c3ccc(OC)cc3)nc2c1,CS(C)=O,413.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3c[nH]cn3)nc2c1,CS(C)=O,400.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccc(Br)cc3)nc2c1,CS(C)=O,388.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccc(C)o3)[n+](C)c2c1,CS(C)=O,399.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccc(C)o3)nc2c1,CS(C)=O,398.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccc(Cl)o3)nc2c1,CS(C)=O,392.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccc(O)cc3O)nc2c1,CS(C)=O,394.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccc(OC)cc3)nc2c1,CS(C)=O,387.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccc(S(=O)(=O)O)o3)nc2c1,CS(C)=O,393.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3cccc(OC)c3)nc2c1,CS(C)=O,384.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3ccccc3S(=O)(=O)O)nc2c1,CS(C)=O,382.0
COC(=O)c1ccn2c(NC3CCCCC3)c(-c3cccn3C)nc2c1,CS(C)=O,392.0
COC(=O)c1ccn2c(NC3CCCCC3)c(/C(C)=C/c3ccccc3)nc2c1,CS(C)=O,392.0
COC(=O)c1ccn2c(NC3CCCCC3)c(/C=C/c3ccco3)nc2c1,CS(C)=O,413.0
COC(=O)c1ccn2c(NCC(=O)OC(C)(C)C)c(/C=C/c3ccc(OC)cc3)nc2c1,CS(C)=O,410.0
COC(=O)c1ccn2c(NCCN3CCOCC3)c(/C=C/c3ccc(OC)cc3)nc2c1,CS(C)=O,384.0
COC(=O)c1ccn2c(NCc3ccccc3)c(/C=C/c3ccc(OC)cc3)nc2c1,CS(C)=O,419.0
COC(=O)c1ccn2c(Nc3ccc(F)cc3)c(/C=C/c3ccc(OC)cc3)nc2c1,CS(C)=O,400.0
COC(=O)c1ccn2c3c(c(-c4ccc(Br)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,393.0
COC(=O)c1ccn2c3c(c(-c4ccc(C#N)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,394.0
COC(=O)c1ccn2c3c(c(-c4ccc(C)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,396.0
COC(=O)c1ccn2c3c(c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,412.0
COC(=O)c1ccn2c3c(c(-c4ccc(OC)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,400.0
COC(=O)c1ccn2cc(-c3ccc(OC)cc3)nc2c1,CS(C)=O,355.0
COC(=O)c1ccnc(N)c1,CS(C)=O,342.0
COC(=O)c1nc(-c2ccc(OC)cc2)oc1C,C1CCCCC1,275.0
COC(=O)c1nc(-c2ccc(OC)cc2)oc1C,CC#N,276.0
COC(=O)c1nc(-c2ccc(OC)cc2)oc1C,CCO,278.0
COC(=O)c1nc(-c2ccc(OC)cc2)oc1C,CCOC(C)=O,276.0
COC(=O)c1nc(-c2ccccc2)oc1C,C1CCCCC1,267.0
COC(=O)c1nc(-c2ccccc2)oc1C,CC#N,267.0
COC(=O)c1nc(-c2ccccc2)oc1C,CCO,267.0
COC(=O)c1nc(-c2ccccc2)oc1C,CCOC(C)=O,267.0
COC(=O)c1nc(-c2ccccc2)oc1C,O,267.0
COC(=O)c1nc(-c2ccco2)oc1C,C1CCCCC1,276.0
COC(=O)c1nc(-c2ccco2)oc1C,CC#N,276.0
COC(=O)c1nc(-c2ccco2)oc1C,CCO,277.0
COC(=O)c1nc(-c2ccco2)oc1C,CCOC(C)=O,276.0
COC(=O)c1nc(Br)c(-c2ccccc2)o1,C1CCCCC1,307.0
COC(=O)c1nc(Cl)c(-c2ccccc2)o1,C1CCCCC1,307.0
COC(=O)c1nc2c(N(C)C)nc(N)nc2n1Cc1ccccc1,C1COCCO1,334.0
COC(=O)c1nc2c(N(C)C)nc(N)nc2n1Cc1ccccc1,CC#N,332.0
COC(=O)c1nc2c(N(C)C)nc(N)nc2n1Cc1ccccc1,CO,331.0
COC(=O)c1nc2c(N(C)C)nc(N)nc2n1Cc1ccccc1,ClCCl,330.0
COC(=O)c1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,C1COCCO1,313.0
COC(=O)c1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,CC#N,316.0
COC(=O)c1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,CO,321.0
COC(=O)c1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,ClCCl,315.0
COC(=O)c1nc2cnc(N(C)C)nc2n1Cc1ccccc1,C1COCCO1,358.0
COC(=O)c1nc2cnc(N(C)C)nc2n1Cc1ccccc1,CC#N,359.0
COC(=O)c1nc2cnc(N(C)C)nc2n1Cc1ccccc1,CO,362.0
COC(=O)c1nc2cnc(N(C)C)nc2n1Cc1ccccc1,ClCCl,362.0
COC(=O)c1nc2cnc(N)nc2n1Cc1ccccc1,C1COCCO1,331.0
COC(=O)c1nc2cnc(N)nc2n1Cc1ccccc1,CC#N,330.0
COC(=O)c1nc2cnc(N)nc2n1Cc1ccccc1,CO,335.0
COC(=O)c1nc2cnc(N)nc2n1Cc1ccccc1,ClCCl,328.0
COC(=O)c1nc2cnc(N)nc2n1Cc1ccccc1,O,325.0
COC(=O)c1noc(-c2ccccc2)c1Br,C1CCCCC1,307.0
COC(=O)c1noc(-c2ccccc2)c1Cl,C1CCCCC1,307.0
COC(C=Cc1cc2c3c(c1)CCCN3CCC2)=C1C(=O)c2ccccc2C1=O,C1CCCCC1,562.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4cc(-c5cccs5)ccc4nc2C3(Cl)C1(OC)OC,CC#N,366.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4cc(-c5cccs5)ccc4nc2C3(Cl)C1(OC)OC,CCCCCC,358.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4cc(-c5cccs5)ccc4nc2C3(Cl)C1(OC)OC,CCOC(C)=O,362.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4cc(-c5cccs5)ccc4nc2C3(Cl)C1(OC)OC,CO,368.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4cc(-c5cccs5)ccc4nc2C3(Cl)C1(OC)OC,Cc1ccccc1,362.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4cc(-c5cccs5)ccc4nc2C3(Cl)C1(OC)OC,ClC(Cl)Cl,366.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4cc(-c5cccs5)ccc4nc2C3(Cl)C1(OC)OC,ClCCl,367.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4ccc(-c5cccs5)cc4nc2C3(Cl)C1(OC)OC,CC#N,366.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4ccc(-c5cccs5)cc4nc2C3(Cl)C1(OC)OC,CCCCCC,358.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4ccc(-c5cccs5)cc4nc2C3(Cl)C1(OC)OC,CCOC(C)=O,362.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4ccc(-c5cccs5)cc4nc2C3(Cl)C1(OC)OC,CO,369.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4ccc(-c5cccs5)cc4nc2C3(Cl)C1(OC)OC,Cc1ccccc1,364.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4ccc(-c5cccs5)cc4nc2C3(Cl)C1(OC)OC,ClC(Cl)Cl,368.0
COC1(OC)C2(Cl)c3nc4ccc(-c5cccs5)cc4nc3C1(Cl)C1C[C@@H]3[C@H](CC12)C1(Cl)c2nc4ccc(-c5cccs5)cc4nc2C3(Cl)C1(OC)OC,ClCCl,369.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CC#N,617.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CC(C)=O,624.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CC(C)CO,576.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CC(C)O,585.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CCC#N,620.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CCCCCCO,584.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CCCCCO,588.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CCCCO,576.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CCCO,577.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CCO,568.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CN(C)C=O,621.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CN(C)P(=O)(N(C)C)N(C)C,629.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CO,537.0
COC1=C/C(=C\C=C2C=CN(Cc3ccc(Br)cc3)C=C2)C=CC1=O,CS(C)=O,619.0
COC1=NC2(C(C#N)=C(N)Oc3ccc4ccccc4c32)C(c2ccc(N(C)C)cc2)=C1C#N,C1CCOC1,416.0
COC1=NC2(C(C#N)=C(N)Oc3ccc4ccccc4c32)C(c2ccc(N(C)C)cc2)=C1C#N,CS(C)=O,434.0
COC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(-c3ccc(N(C)C)cc3)s2)=C1C#N,C1CCOC1,465.0
COC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(-c3ccc(N(C)C)cc3)s2)=C1C#N,CS(C)=O,484.0
COC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(N(C)C)cc2)=C1C#N,C1CCOC1,412.0
COC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(N(C)C)cc2)=C1C#N,CS(C)=O,427.0
COC1=[N+]2C(=C(c3ccccc3)c3cc(SC#N)c(OC)n3[B-]2(F)F)C=C1SC#N,CC#N,513.0
COC1=[N+]2C(=C(c3ccccc3)c3cc(SC#N)c(OC)n3[B-]2(F)F)C=C1SC#N,CCCCCC,518.0
COC1=[N+]2C(=C(c3ccccc3)c3cc(SC#N)c(OC)n3[B-]2(F)F)C=C1SC#N,CCOC(C)=O,515.0
COC1=[N+]2C(=C(c3ccccc3)c3cc(SC#N)c(OC)n3[B-]2(F)F)C=C1SC#N,CO,512.0
COC1=[N+]2C(=C(c3ccccc3)c3cc(SC#N)c(OC)n3[B-]2(F)F)C=C1SC#N,ClCCl,518.0
COC1=[N+]2C(=C(c3ccccc3)c3ccc(OC)n3[B-]2(F)F)C=C1SC#N,CC#N,504.0
COC1=[N+]2C(=C(c3ccccc3)c3ccc(OC)n3[B-]2(F)F)C=C1SC#N,CCCCCC,514.0
COC1=[N+]2C(=C(c3ccccc3)c3ccc(OC)n3[B-]2(F)F)C=C1SC#N,CCOC(C)=O,506.0
COC1=[N+]2C(=C(c3ccccc3)c3ccc(OC)n3[B-]2(F)F)C=C1SC#N,CO,497.0
COC1=[N+]2C(=C(c3ccccc3)c3ccc(OC)n3[B-]2(F)F)C=C1SC#N,ClCCl,515.0
COC1CCC2/C3=C4\CC/C5=C(\C6C(C)CC(C)CC6C)C6=N/C(=C(/C7CCC(C(=O)O)CC7)C7CCC(/C(C8C(C)CC(C)CC8C)=C8/C=C(C3=N8)C3CCCC1C32)N7[Zn]N45)C=C6,ClCCl,679.0
COCC(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,429.0
COCC1COc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc(C=C(C#N)C(=O)O)c2O1,ClC(Cl)Cl,491.0
COCCC1(CCOC)c2cc(-c3ccc(OC)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(CCOC)(CCOC)c3cc(-c5ccc(OC)cc5)ccc3-4)cc21,CN(C)C=O,360.0
COCCC1=Cc2nc1ccc1[nH]c(c3nc(ccc4[nH]c2cc4CCOC)C(CCOC)=C3)c(CN(C)C)c1CCOC,Cc1ccccc1,643.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(N)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,716.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(NC(=O)CCCC(=O)O)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,645.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(NC(=O)CCCC(=O)OC)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,670.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(NC(C)=O)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,670.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(O)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,680.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(OC(=O)CNC(=O)OC(C)(C)C)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,644.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(OC(C)=O)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,647.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(c(OC)cc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,684.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(ccc3[nH]c2cc3CCO)C(CCOC)=C1,Cc1ccccc1,637.0
COCCC1=Cc2nc1ccc1[nH]c(cc1CCOC)c1nc(ccc3[nH]c2cc3CCOC)C(CCOC)=C1,Cc1ccccc1,638.0
COCCN(CCOC)c1ccc(/C=C/c2sc3c4nc(C)sc4ccc3[n+]2C)cc1,CO,533.0
COCCN(CCOC)c1ccc(/C=C/c2sc3c4nc(C)sc4ccc3[n+]2C)cc1,ClC(Cl)Cl,555.0
COCCN1C(=O)/C(=C/c2cccc(N(C)C)c2)N=C1C,C1CCOC1,353.0
COCCN1C(=O)/C(=C/c2cccc(N(C)C)c2)N=C1C,CC#N,353.0
COCCN1C(=O)/C(=C/c2cccc(N(C)C)c2)N=C1C,CCCCCC,352.0
COCCOCCN1C(=O)C2=C(c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)N(CCOCCOC)C(=O)C2=C1c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,521.0
COCCOCCN1C(=O)C2=C(c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)N(CCOCCOC)C(=O)C2=C1c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,O,527.0
COCCOCCN1C(=O)C2=C(c3ccc(Br)cc3)N(CCOCCOC)C(=O)C2=C1c1ccc(Br)cc1,ClCCl,472.0
COCCOCCN1C(=O)C2=C(c3ccc(I)cc3)N(CCOCCOC)C(=O)C2=C1c1ccc(I)cc1,ClCCl,474.0
COCCOCCOC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(N(C)C)cc2)=C1C#N,C1CCOC1,411.0
COCCOCCOC1=NC2(C(C#N)=C(N)Oc3ccccc32)C(c2ccc(N(C)C)cc2)=C1C#N,CS(C)=O,427.0
COCCOCCOCCN1C(=O)C2=C(c3ccncc3)NC(=O)C2=C1c1ccncc1,ClCCl,475.0
COCCOCCOCCN1C(=O)C2=C(c3ccncc3)NC(=O)C2=C1c1ccncc1,O,474.0
COCCOCCOCCN1C(=O)c2cc(NCCOCCO)c3c4c(cc(NCCOCCO)c(c24)C1=O)C(=O)N(CCOCCOCCOC)C3=O,CO,604.0
COCCOCCOCCN1C(=O)c2cc(NCCOCCO)c3c4c(cc(NCCOCCO)c(c24)C1=O)C(=O)N(CCOCCOCCOC)C3=O,ClC(Cl)Cl,610.0
COCCOCCOCCN1C(=O)c2cc(NCCOCCO)c3c4c(cc(NCCOCCO)c(c24)C1=O)C(=O)N(CCOCCOCCOC)C3=O,O,621.0
COCCOCCOCCN1c2ccccc2Sc2cc(C3=C(C#N)C(NCCN)=NC34C(C#N)=C(N)Oc3ccccc34)ccc21,C1CCOC1,422.0
COCCOCCOCCN1c2ccccc2Sc2cc(C3=C(C#N)C(NCCN)=NC34C(C#N)=C(N)Oc3ccccc34)ccc21,CS(C)=O,427.0
COCCOCCOCCNc1cc2c3c(c(NCCOCCOCCOC)cc4c3c1C(=O)N(CCOCCOCCOC)C4=O)C(=O)N(CCOCCOCCOC)C2=O,CO,605.0
COCCOCCOCCNc1cc2c3c(c(NCCOCCOCCOC)cc4c3c1C(=O)N(CCOCCOCCOC)C4=O)C(=O)N(CCOCCOCCOC)C2=O,ClC(Cl)Cl,610.0
COCCOCCOCCNc1cc2c3c(c(NCCOCCOCCOC)cc4c3c1C(=O)N(CCOCCOCCOC)C4=O)C(=O)N(CCOCCOCCOC)C2=O,O,623.0
COCCOCCOCCOCC(COCCOCCOCCOC)Oc1cc(/C=C/c2ccc(/C=C(\C#N)c3ccccc3)cc2)c(OC(COCCOCCOCCOC)COCCOCCOCCOC)cc1/C=C/c1ccc(/C=C(\C#N)c2ccccc2)cc1,ClCCl,433.0
COCCOCCOCCOCC(COCCOCCOCCOC)Oc1cc(/C=C/c2ccc(/C=C(\C#N)c3ccccn3)cc2)c(OC(COCCOCCOCCOC)COCCOCCOCCOC)cc1/C=C/c1ccc(/C=C(\C#N)c2ccccn2)cc1,ClCCl,443.0
COCCOCCOCCOCC(COCCOCCOCCOC)Oc1cc(/C=C/c2ccc(/C=C(\C#N)c3ccncc3)cc2)c(OC(COCCOCCOCCOC)COCCOCCOCCOC)cc1/C=C/c1ccc(/C=C(\C#N)c2ccncc2)cc1,ClCCl,445.0
COCCOCCOCCOCC(COCCOCCOCCOC)Oc1cc(/C=C/c2ccc(C=C(C#N)C#N)cc2)c(OC(COCCOCCOCCOC)COCCOCCOCCOC)cc1/C=C/c1ccc(C=C(C#N)C#N)cc1,ClCCl,465.0
COCCOCCOCCOCC(COCCOCCOCCOC)Oc1cc(/C=C/c2ccc(C=C3C(=O)c4ccccc4C3=O)cc2)c(OC(COCCOCCOCCOC)COCCOCCOCCOC)cc1/C=C/c1ccc(C=C2C(=O)c3ccccc3C2=O)cc1,ClCCl,489.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CC(C)(C)O,393.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CC(C)CO,392.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CC(C)O,390.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CCCCO,375.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CCCO,365.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CCO,364.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CN(C)C=O,392.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CNC=O,350.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,CO,353.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,NC=O,354.0
COCCOCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOCCOC)cc1C=O,O,394.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CC(C)(C)O,350.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CC(C)CO,350.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CC(C)O,349.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CCCCO,349.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CCCO,349.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CCO,349.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CN(C)C=O,350.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CNC=O,349.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,CO,349.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,NC=O,352.0
COCCOCCOCCOCCOc1ccc(OCCOCCOCCOCCOC)c(C=O)c1,O,351.0
COCCOCCOCCOc1cc(/C=C/c2ccc(C3=C4C(=O)N(CCOCCOC)C(c5ccc(/C=C/c6cc(OCCOCCOCCOC)c(OCCOCCOCCOC)c(OCCOCCOCCOC)c6)cc5)=C4C(=O)N3CCOCCOC)cc2)cc(OCCOCCOCCOC)c1OCCOCCOCCOC,ClCCl,501.0
COCCOCCOCCOc1cc(/C=C/c2ccc(C3=C4C(=O)N(CCOCCOC)C(c5ccc(/C=C/c6cc(OCCOCCOCCOC)c(OCCOCCOCCOC)c(OCCOCCOCCOC)c6)cc5)=C4C(=O)N3CCOCCOC)cc2)cc(OCCOCCOCCOC)c1OCCOCCOCCOC,O,510.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CC(C)(C)O,393.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CC(C)CO,390.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CC(C)O,391.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CCCCO,378.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CCCO,367.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CCO,364.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CN(C)C=O,393.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CNC=O,350.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,CO,354.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,NC=O,354.0
COCCOCCOCCOc1cc(C=O)c(OCCOCCOCCOC)cc1C=O,O,394.0
COCCOCCOCCOc1ccc(-c2ccc(N(c3ccc(-c4ccc(OCCOCCOCCOC)cc4)cc3)c3ccc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)cc3)cc2)cc1,CC#N,455.0
COCCOCCOCCOc1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(/C=C(\C#N)C(=O)O)o4)ccc2N3c2ccc(OCCOCCOCCOC)cc2)cc1,C1CCOC1,451.0
COCCOCCOCCOc1ccc(-c2ccc3c(c2)Sc2cc(/C=C(\C#N)C(=O)O)ccc2N3c2ccc(OOCCOCCOC)cc2)c(OCCOCCOCCOC)c1,C1CCOC1,472.0
COCCOCCOCCOc1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,CN(C)C=O,420.0
COCCOCCOCCOc1ccc(/C=C/C2=[N+]3C(=C(c4cc(OC)cc(OC)c4)c4c(C)c(I)c(/C=C/c5ccc(OCCOCCOCCOC)cc5)n4[B-]3(F)F)C(C)=C2I)cc1,C1CCOC1,664.0
COCCOCCOCCOc1ccc(/C=C/C2=[N+]3C(=C(c4cc(OC)cc(OC)c4)c4c(C)c(I)c(/C=C/c5ccc(OCCOCCOCCOC)cc5)n4[B-]3(F)F)C(C)=C2I)cc1,CS(C)=O,666.0
COCCOCCOCCOc1ccc(/C=C/C2=[N+]3C(=C(c4cc(OC)cc(OC)c4)c4c(C)c(I)c(/C=C/c5ccc(OCCOCCOCCOC)cc5)n4[B-]3(F)F)C(C)=C2I)cc1,ClCCl,664.0
COCCOCCOCCOc1ccc(N2c3ccc(-c4ccc(OC)cc4)cc3Sc3cc(-c4ccc(/C=C(\C#N)C(=O)O)o4)ccc32)cc1,C1CCOC1,454.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CC(C)(C)O,349.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CC(C)CO,349.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CC(C)O,349.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CCCCO,348.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CCCO,348.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CCO,348.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CN(C)C=O,349.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CNC=O,349.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,CO,348.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,NC=O,352.0
COCCOCCOCCOc1ccc(OCCOCCOCCOC)c(C=O)c1,O,350.0
COCCOCCOCN1C(=O)c2ccc3c(-c4ccccc4)c4c5ccc6c7c(ccc(c(-c8ccccc8)c4c4ccc(c2c34)C1=O)c75)C(=O)N(COCCOCCOC)C6=O,ClCCl,630.0
COCCOCCOOc1ccc(N2c3ccc(/C=C(\C#N)C(=O)O)cc3Sc3cc(-c4ccc(CCOCOCOCCOC)cc4)ccc32)cc1,C1CCOC1,469.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CC(C)(C)O,350.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CC(C)CO,350.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CC(C)O,349.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CCCCO,349.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CCCO,349.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CCO,349.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CN(C)C=O,350.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CNC=O,349.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,CO,348.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,NC=O,353.0
COCCOCCOc1ccc(OCCOCCOC)c(C=O)c1,O,350.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CC(C)(C)O,393.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CC(C)CO,391.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CC(C)O,390.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CCCCO,363.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CCCO,363.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CCO,362.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CN(C)C=O,392.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CNC=O,351.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,CO,353.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,NC=O,354.0
COCCOc1cc(C=O)c(OCCOC)cc1C=O,O,391.0
COCCOc1ccc(OCCOC)c(C=O)c1,CC(C)(C)O,350.0
COCCOc1ccc(OCCOC)c(C=O)c1,CC(C)CO,350.0
COCCOc1ccc(OCCOC)c(C=O)c1,CC(C)O,349.0
COCCOc1ccc(OCCOC)c(C=O)c1,CCCCO,349.0
COCCOc1ccc(OCCOC)c(C=O)c1,CCCO,349.0
COCCOc1ccc(OCCOC)c(C=O)c1,CCO,349.0
COCCOc1ccc(OCCOC)c(C=O)c1,CN(C)C=O,350.0
COCCOc1ccc(OCCOC)c(C=O)c1,CNC=O,350.0
COCCOc1ccc(OCCOC)c(C=O)c1,CO,348.0
COCCOc1ccc(OCCOC)c(C=O)c1,NC=O,353.0
COCCOc1ccc(OCCOC)c(C=O)c1,O,349.0
COCC[N+]1=C(/C=C/C=C/C=C/C=C2/N(CCCCCC(=O)O)C3=C(CC(S(=O)(=O)[O-])C=C3)C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,747.0
COCC[N+]1=C(/C=C/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCS(=O)(=O)[O-])C(C)(CCCS(=O)(=O)[O-])c2cc(S(=O)(=O)[O-])ccc21,O,747.0
COCC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)O)ccc21,O,648.0
COCC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCS(=O)(=O)O)C(C)(C)C2CC(S(=O)(=O)O)=CC=C21,O,651.0
COCC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCS(=O)(=O)O)C(C)(C)C2CC(S(=O)(=O)[O-])=CC=C21,O,651.0
COCC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCS(=O)(=O)[O-])C(C)(C)C2CC(S(=O)(=O)[O-])=CC=C21,O,651.0
COCC[N+]1=C(/C=C/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCS(=O)(=O)[O-])C(C)(CCCS(=O)(=O)O)C2CC(S(=O)(=O)[O-])=CC=C21,O,654.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,551.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCS(=O)(=O)O)C(C)(C)c2cc(S(=O)(=O)O)ccc21,O,554.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCS(=O)(=O)O)C(C)(CCCS(=O)(=O)O)c2cc(S(=O)(=O)O)ccc21,O,556.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)O)cc3C2(C)CCCS(=O)(=O)O)C(C)(CCCS(=O)(=O)[O-])c2cc(S(=O)(=O)[O-])ccc21,O,556.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,551.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCS(=O)(=O)O)C(C)(CCCS(=O)(=O)[O-])c2cc(S(=O)(=O)[O-])ccc21,O,556.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCS(=O)(=O)[O-])C(C)(C)c2cc(S(=O)(=O)O)ccc21,O,554.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCS(=O)(=O)[O-])C(C)(C)c2cc(S(=O)(=O)[O-])ccc21,O,554.0
COCC[N+]1=C(/C=C/C=C2/N(CCCCCC(=O)O)c3ccc(S(=O)(=O)[O-])cc3C2(C)CCCS(=O)(=O)[O-])C(C)(CCCS(=O)(=O)[O-])c2cc(S(=O)(=O)[O-])ccc21,O,556.0
COC[C@@H]1COc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc(/C=C(\C#N)C(=O)O)c2O1,ClC(Cl)Cl,491.0
COC[C@@H]1COc2c(/C=C(\C#N)C(=O)O)sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2O1,ClC(Cl)Cl,496.0
COCc1ccccc1C1=c2cc3cc4c5c(c3cc2C2(c3ccccc3Oc3ccccc32)c2cc3c6c7c(cc3cc21)CCCN7CCC6)CCC[N+]=5CCC4,ClCCl,885.0
COCc1ncc(-c2c3ccccc3c(-c3cnc(COC)nc3)c3ccccc23)cn1,CCO,395.0
COCc1ncc(-c2c3ccccc3c(-c3cnc(COC)nc3)c3ccccc23)cn1,ClCCl,397.0
CON(C)C(=O)c1ccc(/C=C/c2ccc(/C=C/c3ccc(C(=O)N(C)OC)cc3)cc2)cc1,c1ccccc1,368.0
CON(OC)c1cc2c3cc(-c4c(C)cc(C)cc4C)cc4c5cc(-c6c(C)cc(C)cc6C)cc6c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)cc8c9cc(-c%10c(C)cc(C)cc%10C)cc%10c%11cc(-c%12c(C)cc(C)cc%12C)cc%12c(c1)c2c1c(c43)c(c65)c(c78)c(c9%10)c1c%11%12,C1CCOC1,452.0
CON(OC)c1cc2c3cc(-c4c(C)cc(C)cc4C)cc4c5cc(-c6c(C)cc(C)cc6C)cc6c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)cc8c9cc(-c%10c(C)cc(C)cc%10C)cc%10c%11cc(-c%12c(C)cc(C)cc%12C)cc%12c(c1)c2c1c(c43)c(c65)c(c78)c(c9%10)c1c%11%12,CC(C)=O,445.0
CON(OC)c1cc2c3cc(-c4c(C)cc(C)cc4C)cc4c5cc(-c6c(C)cc(C)cc6C)cc6c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)cc8c9cc(-c%10c(C)cc(C)cc%10C)cc%10c%11cc(-c%12c(C)cc(C)cc%12C)cc%12c(c1)c2c1c(c43)c(c65)c(c78)c(c9%10)c1c%11%12,CCCCCC,453.0
CON(OC)c1cc2c3cc(-c4c(C)cc(C)cc4C)cc4c5cc(-c6c(C)cc(C)cc6C)cc6c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)cc8c9cc(-c%10c(C)cc(C)cc%10C)cc%10c%11cc(-c%12c(C)cc(C)cc%12C)cc%12c(c1)c2c1c(c43)c(c65)c(c78)c(c9%10)c1c%11%12,Cc1ccccc1,461.0
CON(OC)c1cc2c3cc(-c4c(C)cc(C)cc4C)cc4c5cc(-c6c(C)cc(C)cc6C)cc6c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)cc8c9cc(-c%10c(C)cc(C)cc%10C)cc%10c%11cc(-c%12c(C)cc(C)cc%12C)cc%12c(c1)c2c1c(c43)c(c65)c(c78)c(c9%10)c1c%11%12,ClC(Cl)Cl,449.0
CON(OC)c1cc2c3cc(-c4c(C)cc(C)cc4C)cc4c5cc(-c6c(C)cc(C)cc6C)cc6c7cc(B(c8c(C)cc(C)cc8C)c8c(C)cc(C)cc8C)cc8c9cc(-c%10c(C)cc(C)cc%10C)cc%10c%11cc(-c%12c(C)cc(C)cc%12C)cc%12c(c1)c2c1c(c43)c(c65)c(c78)c(c9%10)c1c%11%12,ClCCl,450.0
CONC(=O)O,CO,378.0
CONc1c([N+](=O)[O-])cc(C(=O)NCC2COCCOCCOCCOCCOCCO2)cc1[N+](=O)[O-],CO,374.0
CONc1c([N+](=O)[O-])cc(C(=O)OC(C)C)cc1[N+](=O)[O-],CO,391.0
CONc1c([N+](=O)[O-])cc(C(=O)OCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1[N+](=O)[O-],CO,394.0
COOCc1noc(-c2ccccc2)c1Br,C1CCCCC1,277.0
COOCc1noc(-c2ccccc2)c1Cl,C1CCCCC1,277.0
COS(=O)(=O)OC,O,746.0
CO[B-]1(OC)N2C=C(Br)C=CC2=N[N+]1=C(C)C,CC(C)=O,407.0
CO[B-]1(OC)N2C=C(Br)C=CC2=N[N+]1=C(C)C,CO,403.0
CO[B-]1(OC)N2C=C(Br)C=CC2=N[N+]1=C(C)C,Cc1ccccc1,410.0
CO[B-]1(OC)N2C=C(Br)C=CC2=N[N+]1=C(C)C,ClCCl,406.0
CO[B-]1(OC)N2C=C(Br)C=CC2=N[N+]1=C(C)C,O,404.0
CO[B-]1(OC)N2C=C(I)C=CC2=N[N+]1=C(C)C,CO,400.0
CO[I]I,CN(C)C=O,540.0
CO[Si](CCCSC(=O)CSc1ccccc1)(OC)OC,ClC(Cl)Cl,249.0
CO[Si](CCCSC(=O)c1ccccc1)(OC)OC,ClC(Cl)Cl,272.0
CO[Si](CCCSC(=O)c1ccccc1C)(OC)OC,ClC(Cl)Cl,280.0
CO[Si](CCCSC(=O)c1ccccc1Cl)(OC)OC,ClC(Cl)Cl,274.0
CO[Si](CCCSC(=O)c1ccccc1N)(OC)OC,ClC(Cl)Cl,348.0
CO[Si](CCCSC(=O)c1ccccc1O)(OC)OC,ClC(Cl)Cl,309.0
CO[Si](CCCSC(=O)c1ccccc1S)(OC)OC,ClC(Cl)Cl,315.0
CO[Si](CCCSC(=O)c1ccccc1[N+](=O)[O-])(OC)OC,ClC(Cl)Cl,265.0
CO[Si](CCCSC(=O)c1ccccn1)(OC)OC,ClC(Cl)Cl,265.0
CO[Si](CCCSC(=O)c1cccnc1)(OC)OC,ClC(Cl)Cl,265.0
CO[Si](CCCSC(=O)c1cccnc1C(=O)SCCC[Si](OC)(OC)OC)(OC)OC,ClC(Cl)Cl,284.0
CO[Si](CCCSC(=O)c1ccco1)(OC)OC,ClC(Cl)Cl,283.0
CO[Si](CCCSC(=O)c1cccs1)(OC)OC,ClC(Cl)Cl,287.0
CO[Si](CCCSC(=O)c1ccncc1)(OC)OC,ClC(Cl)Cl,265.0
CO[Si](CCCSC(=O)c1cnccn1)(OC)OC,ClC(Cl)Cl,263.0
CO[Si](OC)(OC)c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)-c4ccccc4C5(C)C)c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)s2)s1,C1CCOC1,419.0
CO[Si](c1c2ccccc2cc2ccccc12)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,ClC(Cl)Cl,401.0
COc1c(-c2c(OC)c3cccc4ccc5oc(=O)cc2c5c43)c2cc(=O)oc3ccc4cccc1c4c32,CC1CCCO1,476.0
COc1c(-c2ccc(N(C)C)cc2)oc2ccccc2c1=O,C1CCCCC1,361.0
COc1c(-c2ccc(N(C)C)cc2)oc2ccccc2c1=O,CC#N,375.0
COc1c(-c2ccc(N(C)C)cc2)oc2ccccc2c1=O,CCOC(C)=O,372.0
COc1c(/C=C(/C#N)C(=O)O)sc(/C=N/N(c2ccccc2)c2ccccc2)c1OC,C1CCOC1,479.0
COc1c(/C=C2\SC(=S)N(CC(=O)O)C2=O)cc2c3c1CCCN3CCC2,CC#N,493.0
COc1c(/C=N/N(c2ccccc2)c2ccccc2)sc(/C=C(\C#N)C(=O)O)c1OC,C1CCOC1,479.0
COc1c(/C=N/Nc2ccc(C#N)cc2)ccc2ccccc12,CC#N,380.0
COc1c(/C=N/Nc2ccc(C#N)cc2)ccc2ccccc12,CCCCCC,387.0
COc1c(/C=N/Nc2ccc(C#N)cc2)ccc2ccccc12,CO,382.0
COc1c(/C=N/Nc2ccc(C#N)cc2)ccc2ccccc12,CS(C)=O,392.0
COc1c(/C=N/Nc2ccc(C#N)cc2)ccc2ccccc12,ClC(Cl)Cl,385.0
COc1c(Br)c2cc(=O)oc3ccc4cccc1c4c32,CC1CCCO1,475.0
COc1c(Br)cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(O)c1Br,CS(C)=O,563.0
COc1c(Br)cc(Br)cc1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,558.0
COc1c(C(C#N)=Cc2ccc(-c3nnc(C)o3)cc2)ccc2c(OC)c(C(C#N)=Cc3ccc(-c4nnc(C)o4)cc3)ccc12,ClCCl,416.0
COc1c(C(C#N)=Cc2ccc(C#N)cc2)ccc2c(OC)c(C(C#N)=Cc3ccc(C#N)cc3)ccc12,ClCCl,412.0
COc1c(C(C)=O)c(=O)oc2cc(N(C)C)ccc12,ClCCl,373.0
COc1c(C)c2c(c(C)c1Cl)Oc1c(C=O)c(O)c(Cl)c(C)c1C(=O)O2,ClC(Cl)Cl,342.0
COc1c(C)cc(-c2c3ccc(=[NH2+])cc-3n(C)c3c4c(ccc23)NC(C)(C)C=C4C)cc1C,O,505.0
COc1c(C)cc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)cc1C,O,480.0
COc1c(C)cc(-c2c3ccc(=[NH2+])cc-3oc3c4c(ccc23)NC(C)(C)C=C4C)cc1C,O,535.0
COc1c(C)cc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(C)C)ccc23)cc1C,O,525.0
COc1c(C)cc(-c2c3ccc(=[NH2+])cc-3oc3cc(N)ccc23)cc1C,O,500.0
COc1c(C)cc(-c2c3ccc(=[NH2+])cc-3oc3cc(O)ccc23)cc1C,O,495.0
COc1c(C)cc(-c2c3ccc(=[NH2+])cc-3sc3cc(N)ccc23)cc1C,O,520.0
COc1c(C=C(c2ccccc2)c2ccccc2)cc2c3ccccc3n(C)c2c1C=C(c1ccccc1)c1ccccc1,C1CCOC1,476.0
COc1c(C=Cc2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)s2)cc1C=Cc1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,347.0
COc1c(C=Cc2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(/C=C(/C#N)C(=O)O)s2)cc1C=Cc1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,343.0
COc1c(O)ccc2c1C(=O)OC2,CN(C)C=O,482.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,C1COCCO1,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,CCCCCC,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,CCCCCCC,376.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,CCCCO,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,CCO,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,CN(C)C=O,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,Cc1ccccc1,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,ClC(Cl)(Cl)Cl,376.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,ClC(Cl)Cl,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,ClCCl,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,OCC(O)CO,378.0
COc1c2ccccc2c(-c2ccccc2)c2ccccc12,OCCO,379.0
COc1c2ccccc2c(OC)c2c(C#CC(C)(C)C)c3cc4ccccc4cc3c(C#CC(C)(C)C)c12,ClCCl,672.0
COc1c2ccccc2c(OC)c2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc4ccccc4cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c12,ClCCl,686.0
COc1c2ccccc2c(OC)c2c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc4sccc4cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c12,ClCCl,639.0
COc1c2ccccc2c(OC)c2c(C#Cc3ccccc3)c3cc4sccc4cc3c(C#Cc3ccccc3)c12,ClCCl,656.0
COc1c2ccccc2c(OC)c2c1c1c(C)ccc(OC)c1n2C,C1CCCCC1,417.0
COc1c2ccccc2c(OC)c2c1c1c(C)ccc(OC)c1n2C,CC#N,416.0
COc1c2ccccc2c(OC)c2c1c1c(C)ccc(OC)c1n2C,CO,414.0
COc1c2ccccc2c(OC)c2c1c1c(C)ccc(OC)c1n2C,ClCCl,418.0
COc1c2ccccc2c(OC)c2c1c1c(F)cccc1n2C,C1CCCCC1,403.0
COc1c2ccccc2c(OC)c2c1c1c(F)cccc1n2C,CC#N,405.0
COc1c2ccccc2c(OC)c2c1c1c(F)cccc1n2C,CO,404.0
COc1c2ccccc2c(OC)c2c1c1c(F)cccc1n2C,ClCCl,406.0
COc1c2ccccc2c(OC)c2c1c1cc(C)ccc1n2C,C1CCCCC1,410.0
COc1c2ccccc2c(OC)c2c1c1cc(C)ccc1n2C,CC#N,412.0
COc1c2ccccc2c(OC)c2c1c1cc(C)ccc1n2C,CO,410.0
COc1c2ccccc2c(OC)c2c1c1cc(C)ccc1n2C,ClCCl,414.0
COc1c2ccccc2c(OC)c2c1c1cc(Cl)ccc1n2C,C1CCCCC1,413.0
COc1c2ccccc2c(OC)c2c1c1cc(Cl)ccc1n2C,CC#N,415.0
COc1c2ccccc2c(OC)c2c1c1cc(Cl)ccc1n2C,CO,414.0
COc1c2ccccc2c(OC)c2c1c1cc(Cl)ccc1n2C,ClCCl,417.0
COc1c2ccccc2c(OC)c2c1c1cc(F)ccc1n2C,C1CCCCC1,415.0
COc1c2ccccc2c(OC)c2c1c1cc(F)ccc1n2C,CC#N,417.0
COc1c2ccccc2c(OC)c2c1c1cc(F)ccc1n2C,CO,416.0
COc1c2ccccc2c(OC)c2c1c1cc(F)ccc1n2C,ClCCl,419.0
COc1c2ccccc2c(OC)c2c1c1ccc(C(F)(F)F)cc1n2C,C1CCCCC1,416.0
COc1c2ccccc2c(OC)c2c1c1ccc(C(F)(F)F)cc1n2C,CC#N,417.0
COc1c2ccccc2c(OC)c2c1c1ccc(C(F)(F)F)cc1n2C,CO,416.0
COc1c2ccccc2c(OC)c2c1c1ccc(C(F)(F)F)cc1n2C,ClCCl,419.0
COc1c2ccccc2c(OC)c2c1c1ccc(C)cc1n2C,C1CCCCC1,402.0
COc1c2ccccc2c(OC)c2c1c1ccc(C)cc1n2C,CC#N,404.0
COc1c2ccccc2c(OC)c2c1c1ccc(C)cc1n2C,CO,401.0
COc1c2ccccc2c(OC)c2c1c1ccc(C)cc1n2C,ClCCl,405.0
COc1c2ccccc2c(OC)c2c1c1cccc(OC)c1n2C,C1CCCCC1,409.0
COc1c2ccccc2c(OC)c2c1c1cccc(OC)c1n2C,CC#N,409.0
COc1c2ccccc2c(OC)c2c1c1cccc(OC)c1n2C,CO,407.0
COc1c2ccccc2c(OC)c2c1c1cccc(OC)c1n2C,ClCCl,412.0
COc1c2ccccc2c(OC)c2c1c1ccccc1n2C,C1CCCCC1,405.0
COc1c2ccccc2c(OC)c2c1c1ccccc1n2C,CC#N,406.0
COc1c2ccccc2c(OC)c2c1c1ccccc1n2C,CO,405.0
COc1c2ccccc2c(OC)c2c1c1ccccc1n2C,ClCCl,409.0
COc1cc(-c2c3nc(c(-c4cc(OC)c(O)c(OC)c4)c4ccc([nH]4)c(-c4cc(OC)c(OC)c(OC)c4)c4nc(c(-c5cc(OC)c(O)c(OC)c5)c5ccc2[nH]5)C=C4)C=C3)cc(OC)c1O,ClC(Cl)Cl,723.0
COc1cc(-c2c3nc(c(-c4ccc(C(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)O)cc4)c4nc(c(-c5cc(OC)c(OC)c(OC)c5)c5ccc2s5)C=C4)C=C3)cc(OC)c1OC,C1CCOC1,431.0
COc1cc(-c2c3nc(c(-c4ccc(O)c(OC)c4)c4ccc([nH]4)c(-c4ccc(OC)c(OC)c4)c4nc(c(-c5ccc(O)c(OC)c5)c5ccc2[nH]5)C=C4)C=C3)ccc1O,ClC(Cl)Cl,726.0
COc1cc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc(OC)c1OC,CC#N,418.0
COc1cc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc(OC)c1OC,CC(C)=O,420.0
COc1cc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc(OC)c1OC,CC(C)O,416.0
COc1cc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc(OC)c1OC,CO,412.0
COc1cc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc(OC)c1OC,ClC(Cl)Cl,420.0
COc1cc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc(OC)c1OC,ClCCl,420.0
COc1cc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc(OC)c1OC,c1ccccc1,422.0
COc1cc(-c2cc(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)c(OC)cc1-c1ccc(N(C)C)cc1,ClC(Cl)Cl,329.0
COc1cc(-c2cc(N3CCCCC3)c(C#N)c3c2-c2cccc4cccc-3c24)cc(OC)c1OC,O,430.0
COc1cc(-c2cc3c(C#N)c4c5c(oc(=O)c4c(=N)n3[nH]2)-c2ccccc2SC5)cc(OC)c1OC,CN(C)C=O,444.0
COc1cc(-c2ccccc2)c2n[n+](-c3ccc([N+](=O)[O-])cc3)c3ccccc3c2c1,ClCCl,452.0
COc1cc(-c2cnc(-c3cnc4ccccc4c3)o2)cc(OC)c1OC,ClCCl,353.0
COc1cc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c(OC)cc1/C=C/c1ccncc1,C1CCOC1,394.0
COc1cc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c(OC)cc1/C=C/c1ccncc1,CC#N,392.0
COc1cc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c(OC)cc1/C=C/c1ccncc1,CN(C)C=O,397.0
COc1cc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c(OC)cc1/C=C/c1ccncc1,Cc1ccccc1,398.0
COc1cc(-c2nc(-c3ccccc3)c3ccccn23)ccc1O,CC#N,380.0
COc1cc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc(OC)c1OC,ClC(Cl)Cl,374.0
COc1cc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc(OC)c1OC,ClC(Cl)Cl,321.0
COc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c(OC)cc1/C=C/c1nc2ccccc2[nH]1,C1CCOC1,401.0
COc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c(OC)cc1/C=C/c1nc2ccccc2[nH]1,CC#N,398.0
COc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c(OC)cc1/C=C/c1nc2ccccc2[nH]1,CO,391.0
COc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c(OC)cc1/C=C/c1nc2ccccc2[nH]1,ClCCl,400.0
COc1cc(-c2ncc(-c3ccncc3)o2)cc(OC)c1OC,ClCCl,326.0
COc1cc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc(OC)c1OC,C1CCOC1,393.0
COc1cc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc(OC)c1OC,CC#N,391.0
COc1cc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc(OC)c1OC,CC1CCCCC1,392.0
COc1cc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc(OC)c1OC,CCCCCC,392.0
COc1cc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc(OC)c1OC,Cc1ccccc1,396.0
COc1cc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc(OC)c1OC,ClC(Cl)Cl,396.0
COc1cc(-c2sc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)c3c2OCCO3)ccc1C=C(C#N)C(=O)O,C1CCOC1,460.0
COc1cc(/C2=C3\C=CC(=N3)/C(c3cc(OC)c(OC)c(OC)c3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(/N=C/c3ccc(C(=O)O)cc3)cc2)=C2/C=CC(=N2)/C=4c2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC,CN(C)C=O,600.0
COc1cc(/C=C/C(=O)O)ccc1O,O,287.0
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,CCO,503.1
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,CCOCC,492.9
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,CO,500.0
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,CS(C)=O,527.0
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,Cc1ccccc1,495.9
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,ClC(Cl)Cl,497.0
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,ClCCl,497.0
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-](F)(F)O2)ccc1O,c1ccccc1,498.1
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-]3(OC(=O)C(=O)O3)O2)ccc1O,CC#N,525.0
COc1cc(/C=C/C2=CC(/C=C/c3ccc(O)c(OC)c3)=[O+][B-]3(OC(=O)C(CC(=O)O)(CC(=O)O)O3)O2)ccc1O,CC#N,518.0
COc1cc(/C=C/C2=CC(/C=C/c3ccc(OS(=O)(=O)c4ccc(C)cc4)c(OC)c3)=[O+][B-](F)(F)O2)ccc1OS(=O)(=O)c1ccc(C)cc1,ClCCl,460.1
COc1cc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OS(=O)(=O)c4ccc(C)cc4)c(OC)c3)=C2)ccc1O,ClCCl,492.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(Br)c(Br)c1O,CS(C)=O,567.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(Br)c1OC,CS(C)=O,560.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(Cl)c1O,CS(C)=O,567.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(Cl)c1OC,CS(C)=O,559.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(I)c1OC,CS(C)=O,561.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(O)c1O,CS(C)=O,557.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(O)c1OC,CS(C)=O,563.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(OC)c1,CS(C)=O,556.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(OC)c1O,CS(C)=O,575.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(OC)c1OC,CS(C)=O,562.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(OC)c1OC(C)=O,CS(C)=O,574.0
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)ccc1F,CS(C)=O,555.5
COc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)ccc1OC(=O)OC(C)(C)C,CS(C)=O,558.0
COc1cc(/C=C/c2cc(OC)c(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc2OC)c(OC)cc1/C=C/c1cc(OC)c(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1OC,C1CCOC1,444.0
COc1cc(/C=C/c2cc(OC)c(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc2OC)c(OC)cc1/C=C/c1cc(OC)c(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1OC,CC#N,441.0
COc1cc(/C=C/c2cc(OC)c(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc2OC)c(OC)cc1/C=C/c1cc(OC)c(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1OC,Cc1ccccc1,447.0
COc1cc(/C=C/c2ccc(N(c3ccc(/C=C/c4cc(OC)cc(OC)c4)cc3)c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)cc(OC)c1,ClCCl,427.0
COc1cc(/C=C/c2ccc3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc(OC)c1OC,CO,567.0
COc1cc(/C=C/c2ccccc2)cc(OC)c1,CC#N,306.0
COc1cc(/C=C/c2nc(N3CCOCC3)c3c([n+]2[O-])CCCC3)cc(OC)c1OC,ClCCl,390.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1ccncc1,C1CCOC1,415.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1ccncc1,CC#N,410.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1ccncc1,CN(C)C=O,416.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1ccncc1,Cc1ccccc1,416.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(/C=C/c2cc(OC)c(/C=C/c3nc4ccccc4s3)cc2OC)n1,C1CCOC1,436.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(/C=C/c2cc(OC)c(/C=C/c3nc4ccccc4s3)cc2OC)n1,CC#N,435.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(/C=C/c2cc(OC)c(/C=C/c3nc4ccccc4s3)cc2OC)n1,ClC(Cl)Cl,441.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(/C=C/c2cc(OC)c(/C=C/c3nc4ccccc4s3)cc2OC)n1,ClCCl,438.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(C)n1,C1CCOC1,426.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(C)n1,CC#N,423.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(C)n1,ClC(Cl)Cl,430.0
COc1cc(/C=C/c2nc3ccccc3s2)c(OC)cc1/C=C/c1nc(C)nc(C)n1,ClCCl,424.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,C1CCCCC1,354.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,C1COCCO1,367.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,CC#N,362.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,CN(C)C=O,341.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,CO,359.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,O,358.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,OCC(O)CO,364.0
COc1cc(/C=C2/SC(=O)NC2=O)cc(OC)c1O,OCCO,370.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,C1CCCCC1,348.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,C1COCCO1,358.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,CC#N,354.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,CN(C)C=O,340.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,CO,355.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,O,355.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,OCC(O)CO,367.0
COc1cc(/C=C2/SC(=O)NC2=O)ccc1O,OCCO,361.0
COc1cc(/C=C2\C=C(c3ccccc3)C=C2c2ccccc2)cc(OC)c1,C1CCOC1,436.0
COc1cc(Br)cc2cc(-c3cc4cc(Br)cc(OC)c4oc3=O)oc12,CC#N,353.0
COc1cc(Br)cc2cc(-c3cc4cc(Br)cc(OC)c4oc3=O)oc12,CCOC(C)=O,355.0
COc1cc(Br)cc2cc(-c3cc4cc(Br)cc(OC)c4oc3=O)oc12,CS(C)=O,359.0
COc1cc(Br)cc2cc(-c3cc4cc(Br)cc(OC)c4oc3=O)oc12,Cc1ccccc1,360.0
COc1cc(Br)cc2cc(-c3cc4cc(Br)cc(OC)c4oc3=O)oc12,O,359.0
COc1cc(C#Cc2cc(C#Cc3cc(OC)c(OC)c(OC)c3)nc(C#Cc3cc(OC)c(OC)c(OC)c3)n2)cc(OC)c1OC,ClC(Cl)Cl,368.0
COc1cc(C#Cc2ccccc2)c(C#Cc2ccccc2)cc1OC,CC#N,325.0
COc1cc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc(OC)c1OC,CS(C)=O,430.0
COc1cc(C(=O)O)cc(OC)c1O,O,260.0
COc1cc(C(=O)O)ccc1O,C1CCCCC1,287.2
COc1cc(C(=O)O)ccc1O,C1COCCO1,290.0
COc1cc(C(=O)O)ccc1O,CC#N,290.0
COc1cc(C(=O)O)ccc1O,CC(C)(C)O,291.0
COc1cc(C(=O)O)ccc1O,CC(C)CO,292.4
COc1cc(C(=O)O)ccc1O,CC(C)O,291.6
COc1cc(C(=O)O)ccc1O,CCOC(C)=O,290.5
COc1cc(C(=O)O)ccc1O,CO,293.6
COc1cc(C(=O)O)ccc1O,O,284.1
COc1cc(C(=O)Oc2ccc(-n3cc(-c4ccccc4)nn3)c([N+](=O)[O-])c2)cc(OC)c1OC,ClCCl,254.0
COc1cc(C(C#N)=Cc2ccc(C#N)cc2)c(OC)cc1C(C#N)=Cc1ccc(C#N)cc1,ClCCl,442.0
COc1cc(C(C)(C)C)c(-n2c3ccccc3c3ccc4cc(-c5ccc(-c6ccc(-c7ccc(/C=C(\C#N)C(=O)O)s7)s6)s5)sc4c32)cc1C(C)(C)C,ClC(Cl)Cl,488.0
COc1cc(C)c2c(c1C)OC(=O)c1c(C)c(Cl)c(O)c(Cl)c1O2,ClC(Cl)Cl,342.0
COc1cc(C2(c3ccccc3)c3ccccc3-c3ccccc32)ccc1N(c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1OC)c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1OC,C1CCOC1,309.0
COc1cc(C2=C(c3cc(OC)c(OC)c(OC)c3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=Nc2c(-c4cc(OC)c(OC)c(OC)c4)c(-c4cc(OC)c(OC)c(OC)c4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)cc(OC)c1OC,Cc1ccccc1,684.0
COc1cc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=Nc2c(-c4cc(OC)c(OC)c(OC)c4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)cc(OC)c1OC,Cc1ccccc1,675.0
COc1cc(C2=CC(c3ccccc3)=C(c3ccccc3)C2)cc(OC)c1OC,ClCCl,360.0
COc1cc(C2=c3c(c4ccc(C(C)(C)C)cc4c4c(OC)c(OC)c(OC)cc34)=[N+]3C2=Nc2c(-c4cc(OC)c(OC)c(OC)c4)c4c5cc(OC)c(OC)c(OC)c5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)cc(OC)c1OC,Cc1ccccc1,808.0
COc1cc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=Nc2c(-c4cc(OC)c(OC)c(OC)c4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)cc(OC)c1OC,Cc1ccccc1,787.0
COc1cc(C2CC(=O)Oc3c2c2nc4ccc(C)cc4nc2c2ccccc32)cc(OC)c1OC,ClC(Cl)Cl,412.0
COc1cc(C=C(C#Cc2ccccc2)C#Cc2ccccc2)c(OC)cc1C=C(C#Cc1ccccc1)C#Cc1ccccc1,ClC(Cl)Cl,455.0
COc1cc(C=C(C#N)C(=O)O)c(OC)cc1C=Cc1cc(OC)c(N(c2ccccc2)c2ccccc2)cc1OC,CCO,302.0
COc1cc(C=C(C#N)C(=O)O)c(OC)cc1C=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,CCO,304.0
COc1cc(C=C(c2ccccc2)c2ccccc2)ccc1N(c1ccc(C=C(c2ccccc2)c2ccccc2)cc1OC)c1ccc(C=C(c2ccccc2)c2ccccc2)cc1OC,C1CCOC1,395.0
COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O,O,427.0
COc1cc(C=CC(=O)c2nnn(-c3ccnc4cc(Cl)ccc34)c2C)cc(OC)c1OC,CO,235.0
COc1cc(C=Cc2cc(OC)c(OC)c(OC)c2)cc(OC)c1OC,O,328.0
COc1cc(C=Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1OCCO,CO,414.0
COc1cc(C=Cc2nc3ccccc3o2)c(OC)cc1C=Cc1nc(C)nc(C=Cc2cc(OC)c(C=Cc3nc4ccccc4o3)cc2OC)n1,C1CCOC1,502.0
COc1cc(C=O)cc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,CC#N,390.0
COc1cc(C=O)cc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,CO,398.0
COc1cc(C=O)cc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,ClCCl,390.0
COc1cc(Cl)c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(Cl)c1O,CS(C)=O,556.0
COc1cc(Cl)cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1O,CS(C)=O,564.0
COc1cc(Cl)cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1OC,CS(C)=O,556.0
COc1cc(F)c(C(=O)c2cc(F)c(OC)cc2F)cc1F,CCO,301.0
COc1cc(N(CC(=O)[O-])CC(=O)[O-])c2nc(COc3cc(C)ccc3N(CC(=O)[O-])CC(=O)[O-])ccc2c1,O,356.0
COc1cc(N(CC(=O)[O-])CC(=O)[O-])c2ncccc2c1,O,353.0
COc1cc(N(c2ccc(C3(c4ccccc4)c4ccccc4-c4ccccc43)c(OC)c2)c2ccc(C3(c4ccccc4)c4ccccc4-c4ccccc43)c(OC)c2)ccc1C1(c2ccccc2)c2ccccc2-c2ccccc21,C1CCOC1,309.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,C1COCCO1,448.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,CC#N,454.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,CC(C)=O,454.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,CCOC(C)=O,450.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,CN(C)C=O,454.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,CO,454.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,Cc1ccccc1,456.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,ClC(Cl)Cl,452.0
COc1cc(N(c2ccc(C=C(C#N)C#N)c(OC)c2)c2ccc(C=C(C#N)C#N)c(OC)c2)ccc1C=C(C#N)C#N,ClCCl,460.0
COc1cc(N(c2ccc(C=C(c3ccccc3)c3ccccc3)c(OC)c2)c2ccc(C=C(c3ccccc3)c3ccccc3)c(OC)c2)ccc1C=C(c1ccccc1)c1ccccc1,C1CCOC1,394.0
COc1cc(N(c2ccccc2)c2ccccc2)ccc1/C=C1\SC(=S)N(CC(=O)O)C1=O,CC#N,472.0
COc1cc(N2CCCC2)c(OC)cc1/C=C/c1ccc(/C=C/c2ccnc(-c3cc(C)ccn3)c2)cc1,CC#N,403.0
COc1cc(N2CCCC2)c(OC)cc1/C=C/c1ccc(/C=C/c2ccnc(-c3cc(C)ccn3)c2)cc1,ClCCl,408.0
COc1cc(N2CCCC2)c(OC)cc1/C=C/c1ccnc(-c2cc(C)ccn2)c1,ClCCl,407.0
COc1cc(N2CCOCCOCCN(c3cc(OC)c(NC(=O)c4ccc(-c5c6cc(Cl)c(=O)cc-6oc6cc([O-])c(Cl)cc56)c(C(=O)[O-])c4)cc3OC)CCOCC2)c(OC)cc1NC(=O)c1ccc(-c2c3cc(Cl)c(=O)cc-3oc3cc([O-])c(Cl)cc23)c(C(=O)[O-])c1,O,507.0
COc1cc(N=Nc2ccccc2)cc(C=Nn2cc(C(=O)c3ccccc3)c(-c3ccccc3)nc2=O)c1O,CCOC(C)=O,288.0
COc1cc(OC)c(-c2sc(/C=C(\C#N)C(=O)O)c3c2OCCO3)c(OC)c1,CN(C)C=O,402.0
COc1cc(OC)c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(OC)c1,CS(C)=O,578.0
COc1cc(OC)c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1Br,CS(C)=O,571.0
COc1cc(OC)c(/C=C/c2ccc(-c3ccc(-c4ccc(/C=C5\SC(=S)N(CC(=O)O)C5=O)s4)s3)s2)c(OC)c1,CN(C)C=O,558.0
COc1cc(OC)c(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)c(OC)c1,C1CCOC1,506.0
COc1cc(OC)c(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)c(OC)c1,CC#N,501.0
COc1cc(OC)c(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)c(OC)c1,CC(=O)C(C)(C)C,505.0
COc1cc(OC)c(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)c(OC)c1,CC(C)=O,503.0
COc1cc(OC)c(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)c(OC)c1,CCCCCC,505.0
COc1cc(OC)c(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)c(OC)c1,CCOC(C)=O,503.0
COc1cc(OC)c(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)c(OC)c1,CO,503.0
COc1cc(OC)c(C=CC(=C(C#N)C#N)c2cc3c(OC)cc4ccccc4c3oc2=O)c(OC)c1,CO,477.0
COc1cc(OC)c(C=NN=Cc2ccc([N+](=O)[O-])cc2)c(OC)c1,C1COCCO1,360.0
COc1cc(OC)c2c(O)c(/C=C/C3=[N+](CCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)c(=O)oc2c1,CCO,494.0
COc1cc(OC)c2c(O)c(/C=C/C3=[N+](CCCCCC(=O)O)c4ccc(S(=O)(=O)[O-])cc4C3(C)C)c(=O)oc2c1,CCO,494.0
COc1cc(OC)c2c(c1)C(=O)c1cc(OC)cc(OC)c1-2,C1CCCCC1,489.0
COc1cc(OC)c2c(c1)C(=O)c1cc(OC)cc(OC)c1-2,CC#N,504.0
COc1cc(OC)c2c(c1)C(=O)c1cc(OC)cc(OC)c1-2,CCO,506.0
COc1cc(OC)c2c(c1)C(=O)c1ccc(OC)cc1-2,C1CCCCC1,422.0
COc1cc(OC)c2c(c1)C(=O)c1ccc(OC)cc1-2,CC#N,441.0
COc1cc(OC)c2c(c1)C(=O)c1ccc(OC)cc1-2,CCO,442.0
COc1cc(OC)c2c(c1)C(=O)c1ccccc1-2,C1CCCCC1,446.0
COc1cc(OC)c2c(c1)C(=O)c1ccccc1-2,CC#N,455.0
COc1cc(OC)c2c(c1)C(=O)c1ccccc1-2,CCO,455.0
COc1cc(OC)c2c(c1)c1c(c3ccc(C(C)(C)C)cc32)=[N+]2C(=Nc3c(-c4cc(OC)c(OC)c(OC)c4)c4c5cc(OC)cc(OC)c5c5cc(C(C)(C)C)ccc5c4n3[B-]2(F)F)C=1c1cc(OC)c(OC)c(OC)c1,Cc1ccccc1,791.0
COc1cc(OC)c2c(c1)c1cc3oc(=O)cc(C)c3cc1c1cc(OC)cc(OC)c12,ClC(Cl)Cl,390.0
COc1cc(OC)c2cc(-c3ccc(-c4cc5c(OC)cc(OC)cc5oc4=O)cc3)c(=O)oc2c1,ClC(Cl)Cl,372.0
COc1cc(OC)c2cc(-c3cccc(-c4cc5c(OC)cc(OC)cc5oc4=O)c3)c(=O)oc2c1,ClC(Cl)Cl,352.0
COc1cc(OC)c2cc(-c3ccccc3)c(=O)oc2c1,ClC(Cl)Cl,348.0
COc1cc(OC)c2cc(-c3ccccc3CC#N)c(=O)oc2c1,ClC(Cl)Cl,342.0
COc1cc(OC)c2cc(C#N)c(=N)oc2c1,ClCCl,372.0
COc1cc(OC)c2ccc(=O)oc2c1,CC(C)O,324.0
COc1cc(OC)c2ccc(=O)oc2c1,CCO,324.0
COc1cc(OC)c2ccc(=O)oc2c1,CCOCC,318.0
COc1cc(OC)c2ccc(=O)oc2c1,CO,324.0
COc1cc(OC)c2ccc(=O)oc2c1,O,327.0
COc1cc(OC)c2n[n+](-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)c3ccccc3c2c1,ClCCl,480.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,C1CCCCC1,360.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,C1COCCO1,366.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CC#N,364.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CC(C)O,365.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CCCCO,367.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CCO,365.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CCOC(C)=O,365.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CN(C)C=O,370.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CO,364.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,CS(C)=O,372.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,Cc1ccccc1,366.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,ClC(Cl)Cl,367.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,ClCCl,366.0
COc1cc(OC)cc(-c2ccc(-c3ccc(C#N)s3)s2)c1,O,337.0
COc1cc(OC)cc(-c2ccc(C3=CC(c4ccccc4)=C(c4ccccc4)C3)cc2)c1,ClCCl,366.0
COc1cc(OC)cc(-c2nnc(-c3cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,C1CCCCC1,300.0
COc1cc(OC)cc(-c2nnc(-c3cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,C1CCOC1,299.0
COc1cc(OC)cc(-c2nnc(-c3cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,CC#N,301.0
COc1cc(OC)cc(-c2nnc(-c3cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,CCO,300.0
COc1cc(OC)cc(-c2nnc(-c3cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,CS(C)=O,300.0
COc1cc(OC)cc(-c2nnc(-c3cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,ClCCl,300.0
COc1cc(OC)cc(-c2nnc(-c3ccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc3)o2)c1,C1CCCCC1,320.0
COc1cc(OC)cc(-c2nnc(-c3ccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc3)o2)c1,C1CCOC1,320.0
COc1cc(OC)cc(-c2nnc(-c3ccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc3)o2)c1,CC#N,317.0
COc1cc(OC)cc(-c2nnc(-c3ccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc3)o2)c1,CCO,319.0
COc1cc(OC)cc(-c2nnc(-c3ccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc3)o2)c1,CS(C)=O,317.0
COc1cc(OC)cc(-c2nnc(-c3ccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)cc3)o2)c1,ClCCl,321.0
COc1cc(OC)cc(-c2nnc(-c3cccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,C1CCCCC1,290.0
COc1cc(OC)cc(-c2nnc(-c3cccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,C1CCOC1,290.0
COc1cc(OC)cc(-c2nnc(-c3cccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,CC#N,288.0
COc1cc(OC)cc(-c2nnc(-c3cccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,CCO,288.0
COc1cc(OC)cc(-c2nnc(-c3cccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,CS(C)=O,292.0
COc1cc(OC)cc(-c2nnc(-c3cccc(-c4nnc(-c5cc(OC)cc(OC)c5)o4)c3)o2)c1,ClCCl,290.0
COc1cc(OC)cc(-n2cc3ccccc3c/c2=N/S(=O)(=O)c2ccc(C)cc2)c1,CC#N,433.0
COc1cc(OC)cc(C(=O)OCc2c(C)c(=O)n3c(=O)c(C)c(C)n23)c1,CCO,378.0
COc1cc(OC)cc(C2=C(c3cc(OC)c(OC)c(OC)c3)C3=Nc4c(-c5cc(OC)c(OC)c(OC)c5)c(-c5cc(OC)cc(OC)c5)c(-c5ccc(C(C)(C)C)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(C(C)(C)C)cc2)c1,Cc1ccccc1,674.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4c[nH]c5ccc([N+](=O)[O-])cc45)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccc([N+](=O)[O-])cc45)c(I)c(C)c32)c1,C1CCOC1,695.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4c[nH]c5ccc([N+](=O)[O-])cc45)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccc([N+](=O)[O-])cc45)c(I)c(C)c32)c1,CS(C)=O,712.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4c[nH]c5ccc([N+](=O)[O-])cc45)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccc([N+](=O)[O-])cc45)c(I)c(C)c32)c1,ClCCl,690.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4c[nH]c5ccccc45)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccccc45)c(I)c(C)c32)c1,C1CCOC1,715.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4c[nH]c5ccccc45)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccccc45)c(I)c(C)c32)c1,CS(C)=O,727.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4c[nH]c5ccccc45)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccccc45)c(I)c(C)c32)c1,ClCCl,702.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4ccsc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccsc4)c(I)c(C)c32)c1,C1CCOC1,670.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4ccsc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccsc4)c(I)c(C)c32)c1,CS(C)=O,675.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(/C=C/c4ccsc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccsc4)c(I)c(C)c32)c1,ClCCl,670.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(C)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccccc45)c(I)c(C)c32)c1,C1CCOC1,627.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(C)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccccc45)c(I)c(C)c32)c1,CS(C)=O,636.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(C)=[N+]3[B-](F)(F)n3c(/C=C/c4c[nH]c5ccccc45)c(I)c(C)c32)c1,ClCCl,618.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(C)=[N+]3[B-](F)(F)n3c(/C=C/c4ccsc4)c(I)c(C)c32)c1,C1CCOC1,598.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(C)=[N+]3[B-](F)(F)n3c(/C=C/c4ccsc4)c(I)c(C)c32)c1,CS(C)=O,604.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(C)=[N+]3[B-](F)(F)n3c(/C=C/c4ccsc4)c(I)c(C)c32)c1,ClCCl,599.0
COc1cc(OC)cc(C2=C3C(C)=C(I)C(C)=[N+]3[B-](F)(F)n3c(C)c(I)c(C)c32)c1,CS(C)=O,538.0
COc1cc(OC)cc(C2=CC(c3ccccc3)=C(c3ccccc3)C2)c1,ClCCl,355.0
COc1cc(OC)cc(C2=[O+][B-](F)(F)OC(c3ccc4cc(OC)ccc4c3)=C2)c1,ClCCl,427.0
COc1cc(OC)cc(C2=[O+][B-](F)(F)OC(c3ccc4ccccc4c3)=C2)c1,ClCCl,402.0
COc1cc(OC)cc(C2=[O+][B-](F)(F)OC(c3ccccc3)=C2)c1,ClCCl,369.0
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,C1CCOC1,395.7104982
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,C1COCCO1,396.5421524
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CC#N,395.303791
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CC(C)=O,394.1663382
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CC(C)O,397.8357734
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CC1COC(=O)O1,397.1090461
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CCO,398.7876854
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CCOC(C)=O,395.4913981
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CN(C)C(=O)N(C)C,395.5226832
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CN(C)C=O,395.6635277
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CN(C)P(=O)(N(C)C)N(C)C,395.2725404
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CO,399.2175336
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,CS(C)=O,397.5352813
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,ClC(Cl)Cl,399.1060026
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,ClCCl,398.7876854
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,N#Cc1ccccc1,398.3111607
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,NC=O,403.4210102
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,O,403.2745897
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,O=C1CCCO1,396.4792641
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,OC(C(F)(F)F)C(F)(F)F,406.0254172
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,OCC(F)(F)F,403.567537
COc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,OCCO,402.2202558
COc1cc2[nH]c3c(c2cc1OC)CCCC3=O,C1COCCO1,333.9618857
COc1cc2[nH]c3c(c2cc1OC)CCCC3=O,CC#N,333.4002006
COc1cc2[nH]c3c(c2cc1OC)CCCC3=O,CCO,337.0912738
COc1cc2[nH]c3c(c2cc1OC)CCCC3=O,CO,338.2146439
COc1cc2[nH]c3c(c2cc1OC)CCCC3=O,CS(C)=O,338.6158475
COc1cc2[nH]c3c(c2cc1OC)CCCC3=O,ClCCl,338.0541625
COc1cc2[nH]c3c(c2cc1OC)CCCC3=O,c1ccccc1,335.7271815
COc1cc2[nH]c3ccsc3c2cc1OC,CS(C)=O,259.0
COc1cc2c(-c3cc(C(=O)O)ccc3C(=O)O)c3cc(OC)c(=O)c(Cl)c-3oc2c(Cl)c1O,O,520.0
COc1cc2c(-c3ccccc3)c(-c3ccccc3)c3cc(C(C)(C)C)cc4c(-c5ccccc5)c(-c5ccccc5)c(c1)c2[n+]34,ClCCl,316.0
COc1cc2c(-c3ccccc3)c(-c3ccccc3)c3cccc4c(-c5ccccc5)c(-c5ccccc5)c(c1)[n+]2c34,ClCCl,355.0
COc1cc2c(=O)c(C=O)coc2cc1O,O,353.0
COc1cc2c(=O)c(CCCCBr)coc2cc1O,O,346.0
COc1cc2c(=O)c(CCCCN=[N+]=[N-])coc2cc1O,O,346.0
COc1cc2c(=O)c(Cc3ccccc3)coc2cc1O,O,346.0
COc1cc2c(C)cc(=O)oc2c2ccccc12,CCO,371.0
COc1cc2c(CO)cc(=O)oc2c2ccccc12,CCO,365.0
COc1cc2c(COC(=O)[C@H](C)NC(=O)OCc3ccccc3)cc(=O)oc2c2ccccc12,CCO,375.0
COc1cc2c(c(OC)c1OC)c1ccc3cccc4c5cccc6oc(=O)c2c(c65)c1c34,C1CCOC1,417.0
COc1cc2c(c(OC)c1OC)c1cccc3c(-c4ccc(C#N)cc4)nc2n31,CO,469.0
COc1cc2c(c(OC)c1OC)c1cccc3c(-c4ccccc4)nc2n31,CO,469.0
COc1cc2c(c(OC)c1OC)c1cccc3c[n+](Cc4ccccc4)c2n31,CO,399.0
COc1cc2c(cc1-c1ccc(C#N)cc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccc(C#N)cc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,409.0
COc1cc2c(cc1-c1ccc(C(F)(F)F)cc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccc(C(F)(F)F)cc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,404.0
COc1cc2c(cc1-c1ccc(C=O)cc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccc(C=O)cc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,414.0
COc1cc2c(cc1-c1ccc(Cl)cc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccc(Cl)cc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,406.0
COc1cc2c(cc1-c1ccc(F)cc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccc(F)cc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,405.0
COc1cc2c(cc1-c1ccc(N(C)C)cc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccc(N(C)C)cc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,440.0
COc1cc2c(cc1-c1ccc([N+](=O)[O-])cc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccc([N+](=O)[O-])cc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,409.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,405.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,CC#N,406.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,CC(C)=O,407.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,CCOC(C)=O,405.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,CS(C)=O,413.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,Cc1ccccc1,405.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,ClC(Cl)Cl,414.0
COc1cc2c(cc1-c1ccccc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccccc2)cc1C4)C(=O)N(CCC(C)C)C3=O,ClCCl,411.0
COc1cc2c(cc1-c1cccs1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2cccs2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,433.0
COc1cc2c(cc1-c1ccncc1)Cc1c3c(c4c(c1-2)-c1cc(OC)c(-c2ccncc2)cc1C4)C(=O)N(CCC(C)C)C3=O,C1CCOC1,407.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,C1CCOC1,433.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,CC#N,431.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,CCOC(C)=O,430.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,CN(C)C=O,439.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,CO,437.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,CS(C)=O,443.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,Cc1ccccc1,431.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,ClC(Cl)Cl,434.0
COc1cc2c(cc1/C=C(\C#N)c1nc3ccccc3s1)c1ccccc1n2C,ClCCl,435.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,C1CCOC1,463.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,CC#N,460.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,CCO,466.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,CCOC(C)=O,458.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,CN(C)C=O,470.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,CO,466.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,CS(C)=O,476.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,Cc1ccccc1,461.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,ClC(Cl)Cl,470.0
COc1cc2c(cc1/C=C/C(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,ClCCl,466.0
COc1cc2c(cc1/C=C/C1=C/C(=C(\C#N)C(=O)O)c3ccccc3O1)C(C)CC(C)(C)N2C,CCO,448.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,C1CCOC1,475.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,CC#N,477.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,CCO,479.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,CCOC(C)=O,462.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,CN(C)C=O,484.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,CS(C)=O,489.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,Cc1ccccc1,468.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,ClC(Cl)Cl,485.0
COc1cc2c(cc1/C=C/C1=CC(=C(C#N)C#N)CC(C)(C)C1)c1ccccc1n2C,ClCCl,478.0
COc1cc2c(cc1/C=C/c1cc[n+](CC(=O)O)cc1)C(C)CC(C)(C)N2C,ClCCl,514.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,C1CCOC1,423.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,CC#N,422.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,CCOC(C)=O,420.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,CN(C)C=O,428.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,CO,425.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,CS(C)=O,427.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,Cc1ccccc1,425.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,ClC(Cl)Cl,430.0
COc1cc2c(cc1C=C(C#N)C#N)c1ccccc1n2C,ClCCl,427.0
COc1cc2c(cc1C=C(c1ccccc1)c1ccccc1)c1cc(C=C(c3ccccc3)c3ccccc3)ccc1n2C,C1CCOC1,474.0
COc1cc2c(cc1C=CC(=C(C#N)C#N)c1ccccc1)c1ccccc1n2C,CS(C)=O,476.0
COc1cc2c(cc1F)c(=O)c1cc(F)c(OC)cc1n2-c1ccccc1,CCO,378.0
COc1cc2c(cc1F)c(=O)c1cc(F)c(OC)cc1n2C(C)C,CCO,383.0
COc1cc2c(cc1OC)-c1cc3cc4ccccc4nc3nc1C2,CC(C)=O,386.0
COc1cc2c(cc1OC)C1=C3C(=O)N4C=Cc5cc(OC)c(OC)cc5C4=C3C(=O)N1C=C2,CN(C)C=O,593.0
COc1cc2c(cc1OC)C1=C3C(=O)N4C=Cc5cc(OC)c(OC)cc5C4=C3C(=O)N1C=C2,ClC(Cl)Cl,593.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccc(C)cc3)C3(C(C#N)=C(C#N)N1CC2)c1cc(Cl)ccc1-c1ccc(Cl)cc13,ClCCl,315.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccc(C)cc3)C3(C(C#N)=C(C#N)N1CC2)c1ccccc1-c1ccccc13,ClCCl,317.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccc(Cl)cc3)C3(C(C#N)=C(C#N)N1CC2)c1cc(Br)ccc1-c1ccc(Br)cc13,ClCCl,314.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccc(Cl)cc3)C3(C(C#N)=C(C#N)N1CC2)c1cc(Cl)ccc1-c1ccc(Cl)cc13,ClCCl,314.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccc(Cl)cc3)C3(C(C#N)=C(C#N)N1CC2)c1ccccc1-c1ccccc13,ClCCl,314.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccccc3)C3(C(C#N)=C(C#N)N1CC2)c1cc(Br)ccc1-c1ccc(Br)cc13,ClCCl,311.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccccc3)C3(C(C#N)=C(C#N)N1CC2)c1cc(Cl)ccc1-c1ccc(Cl)cc13,ClCCl,310.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccccc3)C3(C(C#N)=C(C#N)N1CC2)c1ccccc1-c1ccccc13,ClCCl,310.0
COc1cc2c(cc1OC)C1=C[C@H](c3ccccc3)C3(C(C(=O)O[C@@H]4C[C@H]5CC[C@@H]4C5)=C(C(=O)O[C@H]4C[C@@H]5CC[C@H]4C5)N1CC2)c1ccccc1-c1ccccc13,ClCCl,314.0
COc1cc2c3c([n+]4c(-c5ccccc5)c(-c5ccccc5)c5ccccc5c4c(-c4ccccc4)c3c1)OC(c1ccccc1)=C2c1ccccc1,ClCCl,468.0
COc1cc2c3c([o+]c(-c4ccccc4)c(-c4ccccc4)c3c1)N1C(c3ccccc3)=C(c3ccccc3)c3ccccc3C1=C2c1ccccc1,ClCCl,468.0
COc1cc2c3c4c(c5ccc(C(C)(C)C)cc5c5c(OC)cc(OC)c(c2c(OC)c1OC)c45)=[N+]1C3=Nc2c3c4cc(OC)c(OC)c(OC)c4c4c(OC)cc(OC)c5c6cc(C(C)(C)C)ccc6c(c3c54)n2[B-]1(F)F,Cc1ccccc1,878.0
COc1cc2c3c4c(c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)cc(c2c(OC)c1OC)c45)=[N+]1C3=Nc2c3c4cc(OC)c(OC)c(OC)c4c4cc(C(C)(C)C)cc5c6cc(C(C)(C)C)ccc6c(c3c54)n2[B-]1(F)F,Cc1ccccc1,826.0
COc1cc2c3cc(OC)c(OC)cc3c3cc4c(C)cc(=O)oc4cc3c2cc1OC,C1CCOC1,366.0
COc1cc2c3cc(OC)c(OC)cc3c3cc4c(C)cc(=O)oc4cc3c2cc1OC,CO,364.0
COc1cc2c3cc(OC)c(OC)cc3c3cc4c(C)cc(=O)oc4cc3c2cc1OC,CS(C)=O,370.0
COc1cc2c3cc(OC)c(OC)cc3c3cc4c(C)cc(=O)oc4cc3c2cc1OC,Cc1ccccc1,366.0
COc1cc2c3cc(OC)c(OC)cc3c3cc4c(C)cc(=O)oc4cc3c2cc1OC,ClC(Cl)Cl,368.0
COc1cc2c3ccccc3c3cncnc3c2c(OC)c1OC,ClCCl,353.0
COc1cc2cc(-c3cc4cc(OC)c(OC)cc4oc3=O)oc2cc1OC,CC#N,404.0
COc1cc2cc(-c3cc4cc(OC)c(OC)cc4oc3=O)oc2cc1OC,CCOC(C)=O,408.0
COc1cc2cc(-c3cc4cc(OC)c(OC)cc4oc3=O)oc2cc1OC,CS(C)=O,411.0
COc1cc2cc(-c3cc4cc(OC)c(OC)cc4oc3=O)oc2cc1OC,Cc1ccccc1,410.0
COc1cc2cc(-c3cc4cc(OC)c(OC)cc4oc3=O)oc2cc1OC,O,358.0
COc1cc2cc(-c3ccc(C(=O)OCOC(C)=O)cc3C(=O)OCOC(C)=O)oc2cc1N1CCOCCOCCN(c2cc3oc(-c4ccc(C(=O)OCOC(C)=O)cc4C(=O)OCOC(C)=O)cc3cc2OC)CCOCCOCC1,O,350.0
COc1cc2cc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)cc3)c(=O)oc2cc1OC,CC#N,400.0
COc1cc2cc(/C=C/c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)c(=O)oc2cc1OC,CC#N,415.0
COc1cc2cc(/C=C/c3ccc(/C=C/c4ccc(C=C(C#N)C(=O)O)cc4)cc3)c(=O)oc2cc1OC,CC#N,415.0
COc1cc2cc(C#Cc3ccc(/C=C(\C#N)C(=O)O)cc3)c(=O)oc2cc1OC,CC#N,398.0
COc1cc2cc(C#Cc3ccc(C=C(C#N)C(=O)O)cc3)c(=O)oc2cc1OC,CC#N,398.0
COc1cc2cc(C#Cc3ccc([N+](=O)[O-])cc3)c(C#Cc3ccc([N+](=O)[O-])cc3)cc2cc1OC,C1CCOC1,361.0
COc1cc2cc(C#Cc3ccc([N+](=O)[O-])cc3)c(C#Cc3ccc([N+](=O)[O-])cc3)cc2cc1OC,ClC(Cl)Cl,362.0
COc1cc2cc(C#Cc3ccc([N+](=O)[O-])cc3)c(C#Cc3ccc([N+](=O)[O-])cc3)cc2cc1OC,ClCCl,360.0
COc1cc2cc(OC)c(-c3ccc([N+](=O)[O-])cc3)cc2cc1-c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,336.0
COc1cc2cc(OC)c(-c3ccc([N+](=O)[O-])cc3)cc2cc1-c1ccc([N+](=O)[O-])cc1,ClCCl,337.0
COc1cc2ccccc2c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1OC,CS(C)=O,565.0
COc1cc2oc(=O)c3c4ccc(C(=O)c5ccccc5)cc4c4ccc5cccc6c(c1)c2c3c4c56,C1CCOC1,425.0
COc1cc2oc(=O)c3c4ccc(N(C)C)cc4c4ccc5cccc6c(c1)c2c3c4c56,C1CCOC1,480.0
COc1cc2sc3cc(OC)c(F)cc3c(=O)c2cc1F,CS(C)=O,316.0
COc1cc2sc3nc(-c4ccccc4)sc3c2cc1OC,CS(C)=O,360.0
COc1cc2sc3nc(-c4ccccc4OC)sc3c2cc1OC,CS(C)=O,365.0
COc1ccc(-c2[o+]c3c(-c4ccc(OC)cc4)c(-c4ccc(OC)cc4)c4cccc5c6ccccc6c(c2-c2ccc(OC)cc2)c3c45)cc1,ClCCl,551.0
COc1ccc(-c2c(-c3ccc(F)cc3)n(C)c3nc(-c4ccc5ccccc5c4)c(-c4ccc(C)cc4)cc23)cc1,C1CCOC1,332.0
COc1ccc(-c2c(-c3ccc(OC)cc3)[n+]3c4ccccc4c(-c4ccc(OC)cc4)c(-c4ccc(OC)cc4)c3c3ccccc23)cc1,ClCCl,493.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C(C)=O)c2ccccc23)cc1,CC#N,410.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C(C)=O)c2ccccc23)cc1,CS(C)=O,413.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C=O)c2cc(Br)ccc23)cc1,CC#N,413.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C=O)c2cc(Br)ccc23)cc1,CS(C)=O,415.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C=O)c2cc(OC)ccc23)cc1,CC#N,406.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C=O)c2cc(OC)ccc23)cc1,CS(C)=O,410.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C=O)c2ccccc23)cc1,CC#N,415.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)n3c(c2-c2ccc(OC)cc2)c(C=O)c2ccccc23)cc1,CS(C)=O,417.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c3c4c(cccc4c2-c2ccccc2)C(=O)c2ccccc2-3)cc1,CC#N,402.0
COc1ccc(-c2c(-c3ccc(OC)cc3)c3c4c(cccc4c2-c2ccccc2)C(=O)c2ccccc2-3)cc1,CO,407.0
COc1ccc(-c2c(-c3ccccc3)c3cc(-c4ccc5ccccc5c4)c(-c4ccc5c(c4)OCO5)nc3n2C)cc1,C1CCOC1,334.0
COc1ccc(-c2c(-c3ccccc3)n(C)c3nc(-c4ccc5ccccc5c4)c(-c4ccc(C)cc4)cc23)cc1,C1CCOC1,332.0
COc1ccc(-c2c(F)c(F)c(-c3ccc(OC)cc3)c(F)c2F)cc1,ClCCl,282.0
COc1ccc(-c2c(N=NC3NC=C([N+](=O)[O-])S3)sc(N)c2C#N)cc1,CC(C)=O,592.0
COc1ccc(-c2c(N=Nc3ccc([N+](=O)[O-])cc3)sc(N)c2C#N)cc1,CC(C)=O,572.0
COc1ccc(-c2c3c(n4cc(C(C)=O)ccc24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,354.0
COc1ccc(-c2c3c(n4cc(C)ccc24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,344.0
COc1ccc(-c2c3c(n4ccc(C(C)=O)cc24)C(=O)N(CCCNC(=O)OC(C)(C)C)C3)cc1,CO,412.0
COc1ccc(-c2c3c(n4ccc(C(C)=O)cc24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,412.0
COc1ccc(-c2c3c(n4ccc(C)cc24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,345.0
COc1ccc(-c2c3c(n4cccc(C(C)=O)c24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,340.0
COc1ccc(-c2c3c(n4cccc(C)c24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,339.0
COc1ccc(-c2c3cc(C(C)=O)ccc3nn2C)o1,CC#N,372.0
COc1ccc(-c2c3cc(C(C)=O)ccc3nn2C)o1,ClCCl,375.0
COc1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,CC#N,367.0
COc1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,ClCCl,370.0
COc1ccc(-c2c3cc4cc(C)sc4cc3c(C#Cc3ccccc3)c3cc4cc(C)sc4cc23)cc1,ClCCl,539.0
COc1ccc(-c2c3cc4ccccc4cc3c(-c3ccc(OC)cc3)c3cc4ccccc4cc23)cc1,ClCCl,602.0
COc1ccc(-c2c3cc4ccccc4cc3c(-c3ccc(OC)cc3)c3cc4sc(C)cc4cc23)cc1,ClCCl,550.0
COc1ccc(-c2c3cc4ccccc4cc3c(C#Cc3ccccc3)c3cc4ccccc4cc23)cc1,ClCCl,635.0
COc1ccc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)cc1,O,485.0
COc1ccc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)cc1OC,O,486.0
COc1ccc(-c2c3ccc(=[NH2+])cc-3oc3c4c(ccc23)NC(C)(C)C=C4C)cc1,O,535.0
COc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N)ccc23)cc1OC,O,500.0
COc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)cc1,O,535.0
COc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)cc1OC,O,535.0
COc1ccc(-c2c3ccc(=[NH2+])cc-3sc3cc(N)ccc23)cc1,O,520.0
COc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc(C#N)cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4ccc2o4)C=C3)cc1,C1CCOC1,452.0
COc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc(C#N)cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4ccc2o4)C=C3)cc1,Cc1ccccc1,453.0
COc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc(C#N)cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4ccc2o4)C=C3)cc1,c1ccccc1,453.0
COc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4ccc2o4)C=C3)cc1,C1CCOC1,446.0
COc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4ccc2o4)C=C3)cc1,Cc1ccccc1,448.0
COc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4ccc2o4)C=C3)cc1,c1ccccc1,448.0
COc1ccc(-c2c3ccccc3c(-c3ccc(OC)cc3)c3cc4ccccc4cc23)cc1,ClCCl,495.0
COc1ccc(-c2c3ccccc3c(-c3ccc(OC)cc3)c3cc4sc(C)cc4cc23)cc1,ClCCl,450.0
COc1ccc(-c2c3ccccc3c(-c3ccc(OC)cc3)c3ccccc23)cc1,ClCCl,376.0
COc1ccc(-c2c3ccccc3c(C#Cc3ccccc3)c3cc4cc(C)sc4cc23)cc1,ClCCl,481.0
COc1ccc(-c2c3ccccc3c(C#Cc3ccccc3)c3cc4ccccc4cc23)cc1,ClCCl,523.0
COc1ccc(-c2c3ccccc3nn2C)o1,CC#N,341.0
COc1ccc(-c2c3ccccc3nn2C)o1,ClCCl,344.0
COc1ccc(-c2c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc([nH]4)c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4nc(c(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c5ccc2[nH]5)C=C4)C=C3)cc1,C1CCOC1,419.0
COc1ccc(-c2c3nc(c(-c4ccc(O)cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClC(Cl)Cl,720.0
COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4nc(c(-c5ccc(N)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClC(Cl)Cl,721.0
COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc(OC)cc4)c4nc(c(-c5ccc(NC(C)=O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClC(Cl)Cl,721.0
COc1ccc(-c2c3nc(c(-c4ccc(OC)cc4)c4ccc([nH]4)c(-c4ccc([N+](=O)[O-])cc4)c4nc(c(-c5ccc(OC)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,419.0
COc1ccc(-c2c3nc(cc4ccc([nH]4)c(-c4ccc(OC)c(OCC(=O)O)c4)c4nc(cc5ccc2[nH]5)C=C4)C=C3)cc1OCC(=O)O,CS(C)=O,633.0
COc1ccc(-c2c3nc(cc4ccc([nH]4)c(-c4ccc(OC)c(OCC(=O)O)c4)c4nc(cc5ccc2[nH]5)CC4)CC3)cc1OCC(=O)O,CS(C)=O,736.0
COc1ccc(-c2c3nc(cc4ccc([nH]4)c(-c4ccc(OC)c(OCCCC(=O)O)c4)c4nc(cc5ccc2[nH]5)CC4)C=C3)cc1OCCCC(=O)O,CS(C)=O,644.0
COc1ccc(-c2cc(-c3ccc(C#N)cc3)nn2C)cc1,ClCCl,281.0
COc1ccc(-c2cc(-c3ccc(C(F)(F)F)cc3)nn2C)cc1,ClCCl,262.0
COc1ccc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc1,CC#N,418.0
COc1ccc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc1,CC(C)=O,420.0
COc1ccc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc1,CC(C)O,414.0
COc1ccc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc1,CO,414.0
COc1ccc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc1,ClC(Cl)Cl,418.0
COc1ccc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc1,ClCCl,422.0
COc1ccc(-c2cc(-c3ccc(C)cc3)nc3c(C#N)c(N4CCCC4)nc(N)c23)cc1,c1ccccc1,424.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC#N,416.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC(C)=O,416.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC(C)O,412.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CO,412.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,ClC(Cl)Cl,420.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,ClCCl,418.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,c1ccccc1,420.0
COc1ccc(-c2cc(-c3ccc(OC)cc3)c3ccc4c(-c5ccc(OC)cc5)cc(-c5ccc(OC)cc5)c5ccc2c3c54)cc1,ClCCl,393.0
COc1ccc(-c2cc(-c3ccccc3)c3n2[B-](F)(F)[N+]2=C4C=NC=CN4[B-](F)(F)[N+]2=C3)cc1,ClCCl,534.0
COc1ccc(-c2cc(-c3ccccc3)cc3c2n[n+](-c2ccc(-c4ccccc4)cc2)c2cc(OC)ccc32)cc1,ClCCl,545.0
COc1ccc(-c2cc(-c3ccccc3)nn2C)cc1,ClCCl,257.0
COc1ccc(-c2cc(-c3nnc(-c4ccc(C)cc4)o3)n(Cc3ccc(C(C)(C)C)cc3)n2)cc1,ClCCl,281.0
COc1ccc(-c2cc(-c3nnc(-c4cccc(Br)c4)o3)n(Cc3ccc(C(C)(C)C)cc3)n2)cc1,ClCCl,275.0
COc1ccc(-c2cc(-c3nnc(-c4ccccc4)o3)n(Cc3ccc(C(C)(C)C)cc3)n2)cc1,ClCCl,273.0
COc1ccc(-c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)c(N3CCCCC3)c2)cc1,CS(C)=O,398.0
COc1ccc(-c2cc(B(c3c(C)cc(C)cc3C)c3c(C)cc(C)cc3C)c(-c3sc(-c4ccc(OC)cc4)cc3P(=O)(c3ccccc3)c3ccccc3)s2)cc1,CO,402.0
COc1ccc(-c2cc(C(C)(C)C)cc3c2n[n+](-c2ccc(C(C)(C)C)cc2)c2cc(OC)ccc32)cc1,ClCCl,538.0
COc1ccc(-c2cc(C)cc3c2n[n+](-c2ccc(C)cc2)c2cc(OC)ccc32)cc1,ClCCl,535.0
COc1ccc(-c2cc(C)nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,C1CCOC1,339.0
COc1ccc(-c2cc(C)nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,CN(C)C=O,340.0
COc1ccc(-c2cc(C)nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,ClC(Cl)Cl,342.0
COc1ccc(-c2cc(N3CCCCC3)c(C#N)c3c2-c2cccc4cccc-3c24)cc1,O,430.0
COc1ccc(-c2cc3c(-c4ccccc4)c(-c4ccc(F)cc4)n(C)c3nc2-c2ccc(C)cc2)cc1,C1CCOC1,333.0
COc1ccc(-c2cc3c(-c4ccccc4)c(-c4ccc(OC)cc4)n(C)c3nc2-c2ccc(C)cc2)cc1,C1CCOC1,332.0
COc1ccc(-c2cc3c(-c4ccccc4)c(-c4ccccc4)oc4c5oc(-c6ccccc6)c(-c6ccccc6)c6cc(-c7ccc(OC)cc7)cc(c(c2)c34)c65)cc1,ClCCl,375.0
COc1ccc(-c2cc3c(=O)[nH]c(-c4ccc(Cl)cc4)cn3n2)cc1,C1CCOC1,334.0
COc1ccc(-c2cc3c(=O)[nH]c(-c4ccc(OC)cc4)cn3n2)cc1,C1CCOC1,330.0
COc1ccc(-c2cc3c(=O)[nH]c(-c4ccccc4)cn3n2)cc1,C1CCOC1,327.0
COc1ccc(-c2cc3c(C#N)c4c5c(oc(=O)c4c(=N)n3[nH]2)-c2ccccc2CC5)cc1,CN(C)C=O,428.0
COc1ccc(-c2cc3c(C#N)c4c5c(oc(=O)c4c(=N)n3[nH]2)-c2ccccc2SC5)cc1,CN(C)C=O,444.0
COc1ccc(-c2cc3c(cc2OC)-c2c(c4c(c5c2-c2cc(OC)c(-c6ccc(OC)cc6)cc2C5)C(=O)N(CCC(C)C)C4=O)C3)cc1,C1CCOC1,417.0
COc1ccc(-c2cc3c(ccc4sc(/C=C/c5cccs5)cc43)s2)cc1,ClCCl,376.0
COc1ccc(-c2cc3c(ccc4sc5ccc6sc(-c7ccc(C#N)cc7)cc6c5c43)s2)cc1,ClCCl,383.0
COc1ccc(-c2cc3c(ccc4sc5ccc6sccc6c5c43)s2)cc1,ClCCl,357.0
COc1ccc(-c2cc3c(ccc4sccc43)s2)cc1,ClCCl,333.0
COc1ccc(-c2cc3c(o2)=CC2=C(C(F)(F)F)c4cc5oc(-c6ccc(OC)cc6)cc5n4[B-](F)(F)[N+]=32)cc1,ClC(Cl)Cl,723.0
COc1ccc(-c2cc3c(o2)=CC2=Cc4c(C)cc(C)n4[B-](F)(F)[N+]=32)c(OC)c1,ClC(Cl)Cl,596.0
COc1ccc(-c2cc3c(o2)=CC2=Cc4cc5oc(-c6ccc(OC)cc6)cc5n4[B-](F)(F)[N+]=32)cc1,ClC(Cl)Cl,672.6666666666666
COc1ccc(-c2cc3c(o2)=CC2=Cc4cc5oc(-c6ccc(OC)cc6OC)cc5n4[B-](F)(F)[N+]=32)c(OC)c1,ClC(Cl)Cl,690.0
COc1ccc(-c2cc3c(s2)-c2sc(-c4ccc(OC)cc4)cc2P(c2ccccc2)(c2ccccc2)=[O+][B-]3(c2c(C)cc(C)cc2C)c2c(C)cc(C)cc2C)cc1,C1CCOC1,415.0
COc1ccc(-c2cc3c(s2)c(-c2ccccc2)cc(=O)n3C)cc1,CC#N,384.0
COc1ccc(-c2cc3c(s2)c(-c2ccccc2)cc(=O)n3C)cc1,ClCCl,386.0
COc1ccc(-c2cc3c(s2)c(C(C)=O)cc(=O)n3C)cc1,CC#N,412.0
COc1ccc(-c2cc3c(s2)c(C(C)=O)cc(=O)n3C)cc1,ClCCl,418.0
COc1ccc(-c2cc3c(s2)c(C(C)=O)cc(=O)n3Cc2ccccc2)cc1,CC#N,420.0
COc1ccc(-c2cc3c(s2)c(C(C)=O)cc(=O)n3Cc2ccccc2)cc1,ClCCl,426.0
COc1ccc(-c2cc3c(s2)c(C)cc(=O)n3C)cc1,CC#N,374.0
COc1ccc(-c2cc3c(s2)c(C)cc(=O)n3C)cc1,ClCCl,376.0
COc1ccc(-c2cc3c4c(c2)CCc2cc(-c5ccc(OC)cc5)cc(c2-4)CC3)cc1,ClC(Cl)Cl,332.1046601
COc1ccc(-c2cc3c4c(ccc5c4c2OC(c2ccccc2)=C5c2ccccc2)C(c2ccccc2)=C(c2ccccc2)O3)c(OC)c1,ClCCl,499.0
COc1ccc(-c2cc3c4c(ccc5c4c2OC(c2ccccc2)=C5c2ccccc2)C(c2ccccc2)=C(c2ccccc2)O3)cc1Br,ClCCl,498.0
COc1ccc(-c2cc3oc(=O)cc(C)c3cc2-c2ccc(OC)c(OC)c2)cc1OC,C1CCOC1,346.0
COc1ccc(-c2ccc(-c3c4c(nc5ccccc35)-c3cc5c(cc3CC4)-c3nc4ccccc4c(-c4ccc(-c6ccc(OC)cc6)cc4)c3CC5)cc2)cc1,ClC(Cl)Cl,376.0
COc1ccc(-c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,ClCCl,298.0
COc1ccc(-c2ccc(-c3ccc(C#N)cc3)cc2)cc1,C1CCCCC1,305.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,C1CCCCC1,369.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,C1COCCO1,373.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CC#N,373.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CC(C)O,376.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CCCCO,377.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CCO,375.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CCOC(C)=O,372.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CN(C)C=O,379.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CO,374.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,CS(C)=O,381.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,Cc1ccccc1,376.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,ClC(Cl)Cl,376.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,ClCCl,377.0
COc1ccc(-c2ccc(-c3ccc(C#N)s3)s2)cc1,O,340.0
COc1ccc(-c2ccc(-c3ccc(F)cc3)cc2)cc1,C1COCCO1,291.0
COc1ccc(-c2ccc(-c3ccc(OC)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)cc1,ClC(Cl)Cl,366.0
COc1ccc(-c2ccc(-c3ccc(OC)cc3)cc2)cc1,C1CCCCC1,293.0
COc1ccc(-c2ccc(-c3ccccc3)cc2)cc1,C1CCCCC1,291.0
COc1ccc(-c2ccc(-c3nc4c5ccccc5c5ccccc5c4n3-c3ccccc3)c3nsnc23)cc1,Cc1ccccc1,419.0
COc1ccc(-c2ccc(-c3oc4c(C)c5c(-c6ccc(-c7ccc(OC)cc7)cc6)c(-c6ccc(-c7ccc(OC)cc7)cc6)oc5c(C)c4c3-c3ccc(-c4ccc(OC)cc4)cc3)cc2)cc1,ClCCl,276.0
COc1ccc(-c2ccc(/C=C/c3cc(C)c4n3[B-](F)(F)[N+]3=CC=CC3=C4)o2)cc1Cl,CS(C)=O,600.0
COc1ccc(-c2ccc(/C=C/c3cnc4ccccc4n3)cc2)cc1,ClCCl,379.0
COc1ccc(-c2ccc(C(C#N)=Cc3ccc(-c4csc(C=C(C#N)c5ccccc5)c4)cc3)cc2)cc1,C1CCOC1,369.0
COc1ccc(-c2ccc(C(C#N)=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1,C1CCCCC1,414.0
COc1ccc(-c2ccc(C3=C4C(=O)N(C(=O)OC(C)(C)C)C(c5ccc(-c6ccc(OC)c(OC)c6)cc5)=C4C(=O)N3C(=O)OC(C)(C)C)cc2)cc1OC,ClCCl,472.0
COc1ccc(-c2ccc(C3=C4C(=O)N(C(=O)OC(C)(C)C)C(c5ccc(-c6ccc(OC)cc6)cc5)=C4C(=O)N3C(=O)OC(C)(C)C)cc2)cc1,ClCCl,468.0
COc1ccc(-c2ccc(C3=C4C(=O)NC(c5ccc(-c6ccc(OC)cc6)cc5)=C4C(=O)N3)cc2)cc1,ClCCl,541.0
COc1ccc(-c2ccc(N(c3ccc(-c4ccc(OC)cc4OC)cc3)c3ccc4c(c3)sc3cc(-c5cc6sc(C=C(C#N)C(=O)O)cc6s5)sc34)cc2)c(OC)c1,C1CCOC1,621.0
COc1ccc(-c2ccc(N(c3ccc(-c4ccc(OC)cc4OC)cc3)c3ccc4c(c3)sc3cc(-c5ccc(C=C(C#N)C(=O)O)s5)sc34)cc2)c(OC)c1,C1CCOC1,626.0
COc1ccc(-c2ccc(N(c3ccc(-c4ccc(OC)cc4OC)cc3)c3ccc4c(c3)sc3cc(C5(C=C(C#N)C(=O)O)CC=C(c6cccs6)S5)sc34)cc2)c(OC)c1,C1CCOC1,646.0
COc1ccc(-c2ccc(N(c3ccc(-c4ccc(OC)cc4OC)cc3)c3ccc4c(c3)sc3cc(C=C(C#N)C(=O)O)sc34)cc2)c(OC)c1,C1CCOC1,588.0
COc1ccc(-c2ccc(N(c3ccc(C#Cc4cc(C#N)c(C#Cc5cc(C#N)ccc5C#N)cc4C#N)cc3)c3ccc(-c4ccc(OC)cc4)cc3)cc2)cc1,ClC(Cl)Cl,498.0
COc1ccc(-c2ccc(OC)cc2)cc1,C1CCCCC1,271.8129927
COc1ccc(-c2ccc3c(c2)C(C)(C)C2(C)NC(=O)CN32)cc1,C1CCOC1,274.0
COc1ccc(-c2ccc3c(c2)C=C2B(N3)OB3Nc4ccc(-c5ccc(OC)cc5)cc4C=C3C(c3ccccc3)=C2c2ccccc2)cc1,ClCCl,425.0
COc1ccc(-c2ccc3c(c2)C=C2B(N3)OB3Nc4ccc(Br)cc4C=C3C(c3ccccc3)=C2c2ccccc2)cc1,ClCCl,419.0
COc1ccc(-c2ccc3c(c2)C=Cc2cc(-c4ccc(OC)cc4)ccc2[Si]3(C)C)cc1,ClCCl,334.0
COc1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(/C=C(\C#N)C(=O)O)o4)ccc2N3c2ccc(OC)cc2)cc1,C1CCOC1,449.0
COc1ccc(-c2ccc3c(c2)[Si](C)(C)c2cc(-c4ccc(OC)cc4)ccc2C=C3)cc1,ClCCl,385.0
COc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OC)cc4)ccc2n3-c2ccc(C(=O)c3ccc4sc5ccccc5c4c3)cc2)cc1,Cc1ccccc1,366.0
COc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OC)cc4)ccc2n3-c2ccc(C(=O)c3ccc4sc5ccccc5c4c3)cn2)cc1,Cc1ccccc1,382.0
COc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(OC)cc4)ccc2n3-c2ccc(C(=O)c3ccc4sc5ccccc5c4c3)nc2)cc1,Cc1ccccc1,390.0
COc1ccc(-c2ccc3c(c2)c2ccccc2n3Cn2c3ccccc3c3cc(-c4ccc(OC)nc4)ccc32)cn1,C1CCOC1,283.0
COc1ccc(-c2ccc3c(c2)sc2[n+]3[B-](F)(F)OC(c3ccc(N(C)C)cc3)=N2)cc1,C1CCOC1,431.0
COc1ccc(-c2ccc3c(c2)sc2[n+]3[B-](F)(F)OC(c3ccc(N(C)C)cc3)=N2)cc1,CC#N,431.0
COc1ccc(-c2ccc3c(c2)sc2[n+]3[B-](F)(F)OC(c3ccc(N(C)C)cc3)=N2)cc1,CC(C)=O,432.0
COc1ccc(-c2ccc3c(c2)sc2[n+]3[B-](F)(F)OC(c3ccc(N(C)C)cc3)=N2)cc1,Cc1ccccc1,431.0
COc1ccc(-c2ccc3c(c2)sc2[n+]3[B-](F)(F)OC(c3ccc(N(C)C)cc3)=N2)cc1,ClCCl,437.0
COc1ccc(-c2ccc3cc4cc(OC)ccc4nc3n2)cc1,CC(C)=O,444.0
COc1ccc(-c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,348.0
COc1ccc(-c2cccc3c2n[n+](-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2cc(OC)ccc32)cc1,ClCCl,580.0
COc1ccc(-c2cccc3c2n[n+](-c2ccccc2)c2cc(OC)ccc32)cc1,ClCCl,552.0
COc1ccc(-c2cccc3cnc(-c4ccc(C#N)cc4)n23)cc1,ClCCl,329.0
COc1ccc(-c2cccc3cnc(-c4ccccc4)n23)cc1,ClCCl,332.0
COc1ccc(-c2cccc3ncc(-c4ccc(C#N)cc4)n23)cc1,ClCCl,329.0
COc1ccc(-c2cccc3ncc(-c4ccccc4)n23)cc1,ClCCl,332.0
COc1ccc(-c2ccccc2)cc1,C1CCCCC1,265.8160553
COc1ccc(-c2ccnc3ncnn23)cc1,ClCCl,326.0
COc1ccc(-c2cn3ccc(C=Cc4ccc(SC)cc4)cc3n2)cc1,Cc1ccccc1,484.0
COc1ccc(-c2cn3ccc(C=Cc4ccccc4)cc3n2)cc1,Cc1ccccc1,433.0
COc1ccc(-c2cn3ccc(C=Cc4cccs4)cc3n2)cc1,Cc1ccccc1,392.0
COc1ccc(-c2cn3nc(-c4ccccc4)cc3c(=O)[nH]2)cc1,C1CCOC1,327.0
COc1ccc(-c2cnc(-c3cc[n+](Cc4cccc(C(=O)ON5C(=O)CCC5=O)c4)cc3)o2)cc1S(=O)(=O)[O-],O,399.0
COc1ccc(-c2cnc(-c3ccccc3)o2)cc1OC,ClCCl,322.0
COc1ccc(-c2cnc(/C=C/c3ccc(C#N)cc3)o2)cc1OC,ClCCl,370.0
COc1ccc(-c2cnc(/C=C/c3ccc(OC)c(OC)c3)o2)cc1,ClCCl,360.0
COc1ccc(-c2cnc(/C=C/c3ccccc3)o2)cc1OC,ClCCl,350.0
COc1ccc(-c2cnc(C#Cc3ccccc3)o2)cc1OC,ClCCl,330.0
COc1ccc(-c2cnc3cccc(-c4ccc(C(C)=O)cc4)n23)cc1,ClCCl,366.0
COc1ccc(-c2cnc3nn4ccccc4c3c2)cc1,C1CCOC1,386.0
COc1ccc(-c2cnc3nn4ccccc4c3n2)cc1,C1CCOC1,400.0
COc1ccc(-c2cnn(-c3ccc(C#N)cc3)n2)cc1,CO,318.0
COc1ccc(-c2cnn(-c3ccc(Cl)cc3)n2)cc1,CO,287.0
COc1ccc(-c2cnn(-c3ccc(F)cc3)n2)cc1,CO,283.0
COc1ccc(-c2cnn(-c3ccccc3)n2)cc1,CO,284.0
COc1ccc(-c2coc3cc(O)ccc3c2=O)cc1,O,287.0
COc1ccc(-c2csc(-c3ccncc3)n2)cc1,CC#N,394.0
COc1ccc(-c2csc(-c3ccncc3)n2)cc1,CCO,340.0
COc1ccc(-c2csc(-c3ccncc3)n2)cc1,CN(C)C=O,340.0
COc1ccc(-c2csc(-c3ccncc3)n2)cc1,CS(C)=O,341.0
COc1ccc(-c2csc(-c3ccncc3)n2)cc1,Cc1ccccc1,340.0
COc1ccc(-c2csc(-c3ccncc3)n2)cc1,ClCCl,401.0
COc1ccc(-c2csc(/C(C#N)=C/c3c(Cl)cccc3Cl)n2)cc1,CC#N,360.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc(C#N)cc3)n2)cc1,CC#N,389.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc(C#N)cc3)n2)cc1,CCO,395.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc(C#N)cc3)n2)cc1,CN(C)C=O,395.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc(C#N)cc3)n2)cc1,Cc1ccccc1,400.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc(C#N)cc3)n2)cc1,ClCCl,396.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc(Cl)cc3)n2)cc1,CC#N,376.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc(Cl)cc3Cl)n2)cc1,CC#N,377.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccc([N+](=O)[O-])cc3)n2)cc1,CC#N,399.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccccc3Cl)n2)cc1,CC#N,372.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccncc3)n2)cc1,CC#N,382.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccncc3)n2)cc1,CCO,392.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccncc3)n2)cc1,CN(C)C=O,388.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccncc3)n2)cc1,CS(C)=O,390.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccncc3)n2)cc1,Cc1ccccc1,392.0
COc1ccc(-c2csc(/C(C#N)=C/c3ccncc3)n2)cc1,ClCCl,389.0
COc1ccc(-c2csc(/C(C#N)=C\Nc3ccc(C#N)cc3)n2)cc1,CC#N,376.0
COc1ccc(-c2csc(/C(C#N)=C\Nc3ccc(C#N)cc3)n2)cc1,CCO,378.0
COc1ccc(-c2csc(/C(C#N)=C\Nc3ccc(C#N)cc3)n2)cc1,CN(C)C=O,380.0
COc1ccc(-c2csc(/C(C#N)=C\Nc3ccc(C#N)cc3)n2)cc1,Cc1ccccc1,381.0
COc1ccc(-c2csc(/C(C#N)=C\Nc3ccc(C#N)cc3)n2)cc1,ClCCl,379.0
COc1ccc(-c2csc(/C(C#N)=N\Nc3ccc(C#N)cc3)n2)cc1,CC#N,401.0
COc1ccc(-c2csc(/C(C#N)=N\Nc3ccc(C#N)cc3)n2)cc1,CCO,403.0
COc1ccc(-c2csc(/C(C#N)=N\Nc3ccc(C#N)cc3)n2)cc1,CN(C)C=O,481.0
COc1ccc(-c2csc(/C(C#N)=N\Nc3ccc(C#N)cc3)n2)cc1,Cc1ccccc1,405.0
COc1ccc(-c2csc(/C(C#N)=N\Nc3ccc(C#N)cc3)n2)cc1,ClCCl,404.0
COc1ccc(-c2nc(-c3cc(Cl)sc3C)c(-c3cc(Cl)sc3C)[nH]2)cc1,CC#N,337.0
COc1ccc(-c2nc(-c3cc([N+](=O)[O-])ccc3O)[nH]c2-c2ccc(OC)cc2)cc1,CO,260.0
COc1ccc(-c2nc(-c3ccc(-c4nc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)[nH]4)s3)[nH]c2-c2ccc(OC)cc2)cc1,CC#N,365.0
COc1ccc(-c2nc(-c3ccc(/C=C(\C#N)C(=O)O)s3)n(C)c2-c2ccc(OC)cc2)cc1,ClCCl,418.0
COc1ccc(-c2nc(-c3ccc(C#N)cc3)[nH]c2-c2ccc(OC)cc2)cc1,CO,354.0
COc1ccc(-c2nc(-c3ccc(C(=O)O)cc3)[nH]c2-c2ccc(OC)cc2)cc1,CO,322.0
COc1ccc(-c2nc(-c3ccc(C)cc3)c3ccccn23)cc1,ClC(Cl)Cl,303.0
COc1ccc(-c2nc(-c3ccc(OC)cc3)c(-c3ccc(OC)cc3)[nH]2)cc1,CO,295.0
COc1ccc(-c2nc(-c3ccc(OC)cc3)n3ccccc23)cc1,ClC(Cl)Cl,303.0
COc1ccc(-c2nc(-c3cccc(C#N)c3)[nH]c2-c2ccc(OC)cc2)cc1,CO,327.0
COc1ccc(-c2nc(-c3cccc(OC)c3)[nH]c2-c2ccc(OC)cc2)cc1,CO,300.0
COc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1,CO,305.0
COc1ccc(-c2nc(-c3ccccc3)c(N(C)C)[se]2)cc1,ClC(Cl)Cl,339.0
COc1ccc(-c2nc(-c3ccccc3O)c(-c3ccccc3O)n2-c2ccc(C)cc2)cc1,C1CCOC1,305.0
COc1ccc(-c2nc(-c3ccccc3O)c(-c3ccccc3O)n2-c2ccc(C)cc2)cc1,CS(C)=O,308.0
COc1ccc(-c2nc(-c3ccccc3O)c(-c3ccccc3O)n2-c2ccc(C)cc2)cc1,ClC(Cl)Cl,304.0
COc1ccc(-c2nc(-c3ccccc3O)c(-c3ccccc3O)n2-c2ccc(C)cc2)cc1,ClCCl,304.0
COc1ccc(-c2nc(-c3ccccc3OC)[nH]c2-c2ccc(OC)cc2)cc1,CO,299.0
COc1ccc(-c2nc(/C(C#N)=C/c3ccc(C#N)cc3)sc2-c2ccc(OC)cc2)cc1,CC#N,407.0
COc1ccc(-c2nc(/C(C#N)=C/c3ccc(Cl)cc3)sc2-c2ccc(OC)cc2)cc1,CC#N,394.0
COc1ccc(-c2nc(C(C)=O)c(C)o2)cc1,CC#N,278.0
COc1ccc(-c2nc(C(C)=O)c(C)o2)cc1,CCCCCC,278.0
COc1ccc(-c2nc(C(C)=O)c(C)o2)cc1,CCO,277.0
COc1ccc(-c2nc(C(C)=O)c(C)o2)cc1,CCOC(C)=O,279.0
COc1ccc(-c2nc(C(C)=O)c(C)o2)cc1,CCOCC,276.0
COc1ccc(-c2nc(C(C)=O)c(C)o2)cc1,ClCCl,277.0
COc1ccc(-c2nc(C)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,C1CCOC1,340.0
COc1ccc(-c2nc(C)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,CN(C)C=O,341.0
COc1ccc(-c2nc(C)cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,ClC(Cl)Cl,341.0
COc1ccc(-c2nc(N)nc(C#N)c2C#N)cc1OC,C1COCCO1,347.0
COc1ccc(-c2nc(N)nc(C#N)c2C#N)cc1OC,CC#N,359.0
COc1ccc(-c2nc(N)nc(C#N)c2C#N)cc1OC,CC(C)=O,348.0
COc1ccc(-c2nc(N)nc(C#N)c2C#N)cc1OC,CCO,350.0
COc1ccc(-c2nc(N)nc(C#N)c2C#N)cc1OC,CCOC(C)=O,356.0
COc1ccc(-c2nc(N)nc(C#N)c2C#N)cc1OC,CO,346.0
COc1ccc(-c2nc3c(-c4ccc(C=C(C#N)C(=O)O)o4)cnc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc2-c2ccc(OC)cc2)cc1,ClCCl,497.0
COc1ccc(-c2nc3c(-c4ccc(C=C(C#N)C(=O)O)s4)cnc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc2-c2ccc(OC)cc2)cc1,ClCCl,500.0
COc1ccc(-c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c3nc2-c2ccc(OC)cc2)cc1,ClCCl,469.0
COc1ccc(-c2nc3c(-c4ccc5c(c4)C4CCCC4N5c4ccc(C)cc4)ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c3nc2-c2ccc(OC)cc2)cc1,ClCCl,521.0
COc1ccc(-c2nc3c([nH]2)C2=CC(=O)S[C@]2(C)[C@@]2(C)SC(=O)C=C32)cc1,CC#N,392.0
COc1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1,ClC(Cl)Cl,361.0
COc1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1OC,ClC(Cl)Cl,375.0
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,C1CCOC1,332.0
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CC#N,332.5
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CCCCCC,336.0
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CCOC(C)=O,324.0
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CO,326.0
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,CS(C)=O,331.0
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,Cc1ccccc1,334.0
COc1ccc(-c2nc3c(c4c2-c2ccc(C#N)cc2CC4)-c2ccc(C#N)cc2CC3)cc1,ClCCl,333.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,C1CCOC1,322.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CC#N,321.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CCCCCC,322.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CCOC(C)=O,310.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CO,318.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CS(C)=O,321.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,Cc1ccccc1,320.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClCCl,322.0
COc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1OC,ClC(Cl)Cl,324.0
COc1ccc(-c2nc3c(ccc4ccccc43)oc2=O)cc1,c1ccccc1,410.0
COc1ccc(-c2nc3c4cc(OC)c(OC)c(OC)c4c4cccc2n43)cc1,CO,469.0
COc1ccc(-c2nc3c4ccc(F)cc4c4cccc2n43)cc1,CO,469.0
COc1ccc(-c2nc3c4ccc(OCc5ccccc5)cc4c4cccc2n43)cc1,CO,469.0
COc1ccc(-c2nc3c4ccccc4c4cccc2n43)cc1,CO,469.0
COc1ccc(-c2nc3cc(C#N)ccn3c2NC2CCCCC2)cc1,CS(C)=O,389.0
COc1ccc(-c2nc3cc(Cl)ccn3c2NC2CCCCC2)cc1,CS(C)=O,357.0
COc1ccc(-c2nc3ccc4c(c3nc2-c2ccc(OC)cc2)C(=O)c2ccccc2C4=O)cc1,CCCCCC,274.0
COc1ccc(-c2nc3ccccc3nc2/C=C/N2CCCC2)s1,CC#N,456.0
COc1ccc(-c2nc3ccccc3oc2=O)cc1,c1ccccc1,372.0
COc1ccc(-c2nc3ccccn3c2NC2CCCCC2)cc1,CS(C)=O,350.0
COc1ccc(-c2nc3cnccn3c2NC2CCCCC2)cc1,CS(C)=O,355.0
COc1ccc(-c2nc3ncccc3o2)c(O)c1,CO,332.0
COc1ccc(-c2nc3ncccn3n2)cc1,ClCCl,317.0
COc1ccc(-c2nc3ncccn3n2)cc1OC,ClCCl,325.0
COc1ccc(-c2ncc3cccc(-c4ccc(C(C)=O)cc4)n23)cc1,ClCCl,366.0
COc1ccc(-c2ncc3cccc(-c4ccccc4)n23)cc1,ClCCl,341.0
COc1ccc(-c2nnc(-c3cc(-c4nnc(-c5ccc(OC)cc5)o4)c(-n4c5ccccc5c5ccccc54)cc3-n3c4ccccc4c4ccccc43)o2)cc1,Cc1ccccc1,371.0
COc1ccc(-c2nnc(-c3cc(-n4c5ccccc5c5ccccc54)c(-n4c5ccccc5c5ccccc54)cc3-c3nnc(-c4ccc(OC)cc4)o3)o2)cc1,ClCCl,353.0
COc1ccc(-c2nnc3ccccn23)cc1,ClCCl,282.0
COc1ccc(-c2nnc3ccccn23)cc1OC,ClCCl,290.0
COc1ccc(-c2oc(-c3ccc(OC)cc3)c3c2C=C(C=O)CC(C=O)=C3)cc1,ClC(Cl)Cl,385.0
COc1ccc(-c2oc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4c(Br)c5oc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3Br)cc1,C1CCOC1,741.0
COc1ccc(-c2oc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4c(Br)c5oc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3Br)cc1,ClC(Cl)Cl,746.0
COc1ccc(-c2oc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4cc5oc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3)cc1,C1CCOC1,732.0
COc1ccc(-c2oc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4cc5oc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3)cc1,ClC(Cl)Cl,738.0
COc1ccc(-c2oc3cccc4[n+]3c2-c2ccccc2-4)cc1,ClCCl,405.0
COc1ccc(-c2oc3cccc4c5c(-c6ccc(OC)c(OC)c6)c(=N)oc6cccc(c2c34)c65)cc1OC,ClC(Cl)Cl,410.0
COc1ccc(-c2oc3cccc4c5c(-c6ccc(OC)cc6)c(=N)oc6cccc(c2c34)c65)cc1,ClC(Cl)Cl,408.0
COc1ccc(-c2pc3ccccc3s2)cc1,CC#N,347.0
COc1ccc(-c2sc(-c3ccc(C=C(C#N)C(=O)O)s3)nc2OC)cc1,C1CCOC1,477.0
COc1ccc(-c2sc(C=C(C#N)C#N)c3c2OCCO3)cc1,ClCCl,379.0
COc1ccc(-c2sc3c(-c4ccc(OC)cc4)c4n(c3c2-c2ccc(OC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OC)cc5)c5sc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CC#N,587.0
COc1ccc(-c2sc3c(-c4ccc(OC)cc4)c4n(c3c2-c2ccc(OC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OC)cc5)c5sc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CCCCCC,595.0
COc1ccc(-c2sc3c(-c4ccc(OC)cc4)c4n(c3c2-c2ccc(OC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OC)cc5)c5sc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,CN(C)C=O,593.0
COc1ccc(-c2sc3c(-c4ccc(OC)cc4)c4n(c3c2-c2ccc(OC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OC)cc5)c5sc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,Cc1ccccc1,610.0
COc1ccc(-c2sc3c(-c4ccc(OC)cc4)c4n(c3c2-c2ccc(OC)cc2)[B-](F)(F)[N+]2=Cc3c(-c5ccc(OC)cc5)c5sc(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)c5n3[B-](F)(F)[N+]2=C4)cc1,ClCCl,600.0
COc1ccc(-c2sc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4c(Br)c5sc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3Br)cc1,C1CCOC1,764.0
COc1ccc(-c2sc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4c(Br)c5sc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3Br)cc1,ClC(Cl)Cl,766.0
COc1ccc(-c2sc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4cc5sc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3)cc1,C1CCOC1,717.0
COc1ccc(-c2sc3c(c2Br)=[N+]2C(=C(C(F)(F)F)c4cc5sc(-c6ccc(OC)cc6)c(Br)c5n4[B-]2(F)F)C=3)cc1,ClC(Cl)Cl,720.0
COc1ccc(-c2scc3c2OCCO3)cc1,ClCCl,301.0
COc1ccc(-n2c(-c3ccc(-c4cncc5ccccc45)cc3)nc(-c3ccccc3)c2-c2ccccc2)cc1,C1CCOC1,328.0
COc1ccc(-n2c(-c3ccc(-c4cncc5ccccc45)cc3)nc3c4ccccc4c4ccccc4c32)cc1,C1CCOC1,365.0
COc1ccc(-n2c(C)ccc2C)cc1,CC#N,224.0
COc1ccc(-n2c(C)ccc2C)cc1,CCCCCC,222.0
COc1ccc(-n2c(N=Nc3nc4ccccc4s3)ccc2-c2cccs2)cc1,CS(C)=O,530.0
COc1ccc(-n2c3cc(C=C(C#N)C(=O)O)sc3c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc32)cc1,ClC(Cl)Cl,610.0
COc1ccc(-n2c3ccccc3c3c(C)cc4ccccc4c32)cc1,ClCCl,303.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,C1CCOC1,448.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CC#N,444.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CC(C)=O,445.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CCOC(C)=O,443.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CO,449.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CS(C)=O,454.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,Cc1ccccc1,450.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,ClC(Cl)Cl,459.0
COc1ccc(-n2c3ccccc3c3cc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)cc4)ccc32)cc1,CCO,440.0
COc1ccc(-n2c3ccccc3c3cc(N(c4ccc5c(c4)C(C)(C)C(c4ccc(/C=C(\C#N)C(=O)O)cc4)=N5)c4ccc5c(c4)c4ccccc4n5-c4ccc(OC)cc4)ccc32)cc1,C1CCOC1,477.0
COc1ccc(-n2c3ccccc3c3cc(N(c4ccc5c(c4)C(C)(C)C(c4ccc(/C=C(\C#N)C(=O)O)s4)=N5)c4ccc5c(c4)c4ccccc4n5-c4ccc(OC)cc4)ccc32)cc1,C1CCOC1,513.0
COc1ccc(-n2cc3ccccc3c/c2=N/S(=O)(=O)c2ccc(C)cc2)cc1OC,CC#N,434.0
COc1ccc(-n2cccc2)cc1,CC#N,252.0
COc1ccc(-n2cccc2)cc1,CCCCCC,252.0
COc1ccc(-n2cccc2)cc1,ClC(Cl)Cl,325.0
COc1ccc(-n2nc(C#N)c(N3CCC(N4CCCCC4)CC3)n2)cc1,CC#N,325.0
COc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1,CC#N,340.0
COc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1,CCCCCC,335.0
COc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1,CCO,339.0
COc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1,CN(C)C=O,343.0
COc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1,CO,340.0
COc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1,ClC(Cl)Cl,342.0
COc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1OC,CC#N,344.0
COc1ccc(-n2nc(C#N)c(N3CCCCC3)n2)cc1,CC#N,340.0
COc1ccc(-n2nc(C#N)c(N3CCCCCC3)n2)cc1,CC#N,344.0
COc1ccc(-n2nc(C#N)c(N3CCN(c4ccccn4)CC3)n2)cc1,CC#N,321.0
COc1ccc(-n2nc(C#N)c(N3CCOCC3)n2)cc1,CC#N,324.0
COc1ccc(-n2nc(C#N)c(NC3CCCCC3)n2)cc1,CC#N,330.0
COc1ccc(-n2nc(C#N)c(NC3CCCCC3)n2)cc1,CCCCCC,325.0
COc1ccc(-n2nc(C#N)c(NC3CCCCC3)n2)cc1,CCO,333.0
COc1ccc(-n2nc(C#N)c(NC3CCCCC3)n2)cc1,CN(C)C=O,336.0
COc1ccc(-n2nc(C#N)c(NC3CCCCC3)n2)cc1,ClC(Cl)Cl,330.0
COc1ccc(-n2nc(C(=O)c3ccc(Cl)cc3)c(N3CCCC3)n2)cc1,CC#N,381.0
COc1ccc(-n2nc(C(=O)c3ccccc3)c(-c3ccccc3)n2)cc1,C1CCOC1,297.0
COc1ccc(-n2ncc(-c3ccc(F)cc3)n2)cc1,CO,280.0
COc1ccc(-n2ncc(-c3ccccc3)n2)cc1,C1CCOC1,305.0
COc1ccc(-n2ncc(-c3ccccc3)n2)cc1,CO,298.0
COc1ccc(/C(C#N)=C/c2ccc(N(c3ccc(/C=C(\C#N)c4ccc(OC)cc4)cc3)c3ccc(/C=C(\C#N)c4ccc(OC)cc4)cc3)cc2)cc1,C1CCOC1,419.0
COc1ccc(/C(C#N)=C/c2ccc(N(c3ccccc3)c3ccc(/C=C(\C#N)c4ccc(OC)cc4)cc3)cc2)cc1,C1CCOC1,425.0
COc1ccc(/C(C#N)=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,403.0
COc1ccc(/C2=C3/N=C(C(c4ccccc4)=C3c3ccccc3)/C(c3ccc(OC)cc3)=c3\[nH]/c(c(-c4ccccc4)c3-c3ccccc3)=C(/c3ccc(OC)cc3)C3=N/C(=C(/c4ccc(OC)cc4)c4[nH]c2c(-c2ccccc2)c4-c2ccccc2)C(c2ccccc2)=C3c2ccccc2)cc1,ClCCl,731.0
COc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(OC)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2ccc(OC)cc2)cc1,ClCCl,589.0
COc1ccc(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3c(C)cc(C)cc3C)=C3/C=CC2=N3)/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c2ccccc12,ClCCl,552.0
COc1ccc(/C=C(\C#N)c2nc(-c3ccc(Cl)cc3)cs2)cc1,CC#N,373.0
COc1ccc(/C=C(\C#N)c2nc(-c3ccc(OC)cc3)cs2)cc1,CC#N,380.0
COc1ccc(/C=C(\C#N)c2nc3ccccc3s2)cc1,C1CCCCC1,365.0
COc1ccc(/C=C(\C#N)c2nc3ccccc3s2)cc1,CO,375.0
COc1ccc(/C=C(\C)c2nc3ccccc3o2)cc1,C1CCCCC1,320.0
COc1ccc(/C=C(\C)c2nc3ccccc3o2)cc1,CO,325.0
COc1ccc(/C=C(\C)c2nc3ccccc3s2)cc1,C1CCCCC1,330.0
COc1ccc(/C=C(\C)c2nc3ccccc3s2)cc1,CO,330.0
COc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3s2)cc1,C1CCCCC1,350.0
COc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3s2)cc1,CO,350.0
COc1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,CC#N,380.0
COc1ccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)cc1,ClCCl,384.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,C1CCOC1,350.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,C1COCCO1,354.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,CC#N,352.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,CCCO,360.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,CCO,359.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,CN(C)C=O,362.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,CO,357.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,CS(C)=O,365.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,ClC(Cl)Cl,355.0
COc1ccc(/C=C/C(=O)c2ccccc2O)cc1OC,ClCCl,353.0
COc1ccc(/C=C/C(F)(F)F)c(N)c1,C1CCOC1,339.0
COc1ccc(/C=C/C2=C3CCc4ccccc4C3=[O+][B-](F)(F)O2)cc1,ClCCl,467.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,CCO,492.1
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,CCOCC,490.1
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,CO,491.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,CS(C)=O,513.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,Cc1ccccc1,502.1
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,ClC(Cl)Cl,500.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,ClCCl,502.1
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c(OC)c3)=[O+][B-](F)(F)O2)cc1OC,c1ccccc1,504.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c4ccccc34)=[O+][B-](F)(F)O2)c2ccccc12,CC#N,530.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c4ccccc34)=[O+][B-](F)(F)O2)c2ccccc12,CC(C)=O,532.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c4ccccc34)=[O+][B-](F)(F)O2)c2ccccc12,CCOC(C)=O,524.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c4ccccc34)=[O+][B-](F)(F)O2)c2ccccc12,CCOCC,516.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c4ccccc34)=[O+][B-](F)(F)O2)c2ccccc12,ClC(Cl)(Cl)Cl,523.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)c4ccccc34)=[O+][B-](F)(F)O2)c2ccccc12,ClCCl,536.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[N+]3C2=C(c2ccc(-c4ccc5ccccc5n4)s2)c2c(/C=C/c4ccc(OC)cc4)cc(/C=C/c4ccc(OC)cc4)n2[B-]3(F)F)cc1,C1COCCO1,708.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](F)(F)O2)cc1,CC#N,483.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](F)(F)O2)cc1,CC(C)=O,483.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](F)(F)O2)cc1,CCOC(C)=O,480.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](F)(F)O2)cc1,CCOCC,475.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](F)(F)O2)cc1,ClC(Cl)(Cl)Cl,477.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](F)(F)O2)cc1,ClCCl,488.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](OC(C)=O)(OC(C)=O)O2)cc1,C1CCOC1,456.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](OC(C)=O)(OC(C)=O)O2)cc1,CC#N,462.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](OC(C)=O)(OC(C)=O)O2)cc1,CC(C)=O,458.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](OC(C)=O)(OC(C)=O)O2)cc1,CS(C)=O,468.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](OC(C)=O)(OC(C)=O)O2)cc1,Cc1ccccc1,456.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](OC(C)=O)(OC(C)=O)O2)cc1,ClC(Cl)Cl,464.0
COc1ccc(/C=C/C2=CC(/C=C/c3ccc(OC)cc3)=[O+][B-](OC(C)=O)(OC(C)=O)O2)cc1,ClCCl,464.0
COc1ccc(/C=C/C2=CC(c3ccccc3)=[O+][B-](F)(F)O2)cc1,ClCCl,444.0
COc1ccc(/C=C/C2=N/C(=C\c3ccncc3)C(=O)N2C)cc1,C1COCCO1,422.0
COc1ccc(/C=C/C2=N/C(=C\c3ccncc3)C(=O)N2C)cc1,CC#N,428.0
COc1ccc(/C=C/C2=N/C(=C\c3ccncc3)C(=O)N2C)cc1,CCO,433.0
COc1ccc(/C=C/C2=N/C(=C\c3ccncc3)C(=O)N2C)cc1,CCOC(C)=O,423.0
COc1ccc(/C=C/C2=N/C(=C\c3ccncc3)C(=O)N2C)cc1,O,425.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)c4ccccc34)=C2c2ccccc2)c2ccccc12,CC#N,550.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)c4ccccc34)=C2c2ccccc2)c2ccccc12,CC(C)=O,549.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)c4ccccc34)=C2c2ccccc2)c2ccccc12,CCOC(C)=O,542.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)c4ccccc34)=C2c2ccccc2)c2ccccc12,CCOCC,540.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)c4ccccc34)=C2c2ccccc2)c2ccccc12,ClC(Cl)(Cl)Cl,542.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)c4ccccc34)=C2c2ccccc2)c2ccccc12,ClCCl,556.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2ccc(OC)cc2)cc1,ClCCl,506.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2cccc(OC)c2)cc1,ClCCl,504.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2ccccc2)cc1,CC#N,500.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2ccccc2)cc1,CC(C)=O,500.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2ccccc2)cc1,CCOC(C)=O,496.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2ccccc2)cc1,CCOCC,491.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2ccccc2)cc1,ClC(Cl)(Cl)Cl,493.0
COc1ccc(/C=C/C2=[O+][B-](F)(F)OC(/C=C/c3ccc(OC)cc3)=C2c2ccccc2)cc1,ClCCl,505.0
COc1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,C1COCCO1,354.0
COc1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,CC#N,352.0
COc1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,CO,342.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C1CCOC1,417.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C1COCCO1,415.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CC#N,412.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CC1CCCCC1,413.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CO,411.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CS(C)=O,429.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,Cc1ccccc1,419.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,ClC(Cl)Cl,421.0
COc1ccc(/C=C/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,ClCCl,420.0
COc1ccc(/C=C/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,369.0
COc1ccc(/C=C/c2[nH+]ccc3ccccc23)cc1,ClC(Cl)Cl,413.0
COc1ccc(/C=C/c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc(/C=C/c3ccc(N(C)C)cc3)n2)cc1,ClCCl,386.0
COc1ccc(/C=C/c2cc(/C=C/c3ccc(OC)cc3)nc(/C=C/c3ccc(C(F)(F)F)cc3)n2)cc1,ClCCl,370.0
COc1ccc(/C=C/c2cc(/C=C/c3ccc(OC)cc3)nc(/C=C/c3ccc(N(C)C)cc3)n2)cc1,ClCCl,370.0
COc1ccc(/C=C/c2cc(/C=C/c3ccc(OC)cc3)nc(/C=C/c3ccc(OC)cc3)n2)cc1,ClCCl,339.0
COc1ccc(/C=C/c2cc(/C=C/c3ccc(OC)cc3)ncn2)cc1,ClCCl,359.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(Br)c1O,CS(C)=O,556.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(C)c1C,CS(C)=O,565.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(Cl)c1O,CS(C)=O,566.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(Cl)c1OC,CS(C)=O,563.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(F)c1,CS(C)=O,562.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(OC)c1,CS(C)=O,571.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(OC)c1C,CS(C)=O,565.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c2ccccc12,CS(C)=O,575.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,564.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1Br,CS(C)=O,562.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1C,CS(C)=O,561.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1Cl,CS(C)=O,561.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1O,CS(C)=O,568.0
COc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1[N+](=O)[O-],CS(C)=O,557.0
COc1ccc(/C=C/c2cc[nH+]c3ccccc23)cc1,ClC(Cl)Cl,412.0
COc1ccc(/C=C/c2ccc(-c3ccc(C)cn3)nc2)cc1,CC#N,345.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CC#N,337.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CC(C)=O,341.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCC,337.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCCCCO,346.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCCCCO,347.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCCCO,346.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CCCO,345.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CN(C)C=O,351.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CO,345.0
COc1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(-c5cc6ccccc6s5)cc4)o3)cc2)cc1,CS(C)=O,348.0
COc1ccc(/C=C/c2ccc(/C=C/c3cc[n+]4ccc(/C=C/c5ccc(/C=C/c6ccc(OC)cc6)cc5)cc4c3)cc2)cc1,CO,463.0
COc1ccc(/C=C/c2ccc3ccccc3[nH+]2)cc1,ClC(Cl)Cl,412.0
COc1ccc(/C=C/c2ccc3ccccc3n2)cc1,ClC(Cl)Cl,346.0
COc1ccc(/C=C/c2ccc3ccccc3n2)cc1,ClCCl,346.0
COc1ccc(/C=C/c2ccc3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc1,CO,570.0
COc1ccc(/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,347.0
COc1ccc(/C=C/c2ccccc2)cc1,CC#N,317.0
COc1ccc(/C=C/c2ccccc2)cc1OC,CC#N,321.0
COc1ccc(/C=C/c2ccnc3ccccc23)cc1,ClC(Cl)Cl,347.0
COc1ccc(/C=C/c2ccnc3ccccc23)cc1,ClCCl,347.0
COc1ccc(/C=C/c2ccncn2)cc1,ClCCl,338.0
COc1ccc(/C=C/c2nc(-c3ccc(C)cc3)[nH]c2/C=C/c2ccc(OC)cc2)cc1,ClCCl,375.0
COc1ccc(/C=C/c2nc(-c3ccc([N+](=O)[O-])cc3)[nH]c2/C=C/c2ccc(OC)cc2)cc1,ClCCl,455.0
COc1ccc(/C=C/c2nc(-c3ccccc3)[nH]c2/C=C/c2ccc(OC)cc2)cc1,ClCCl,380.0
COc1ccc(/C=C/c2nc(/C=C/c3ccc(N(C)C)cc3)cc(/C=C/c3ccc(N(C)C)cc3)n2)cc1,ClCCl,423.0
COc1ccc(/C=C/c2nc(/C=C/c3ccc(N(C)C)cc3)cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClCCl,420.0
COc1ccc(/C=C/c2nc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClCCl,424.0
COc1ccc(/C=C/c2nc(N3CCOCC3)c3c([n+]2[O-])CCCC3)cc1,ClCCl,391.0
COc1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3o2)cc1,CC#N,368.0
COc1ccc(/C=C/c2nc3ccccc3o2)cc1,C1CCCCC1,330.0
COc1ccc(/C=C/c2nc3ccccc3o2)cc1,CO,340.0
COc1ccc(/C=C/c2nc3ccccc3s2)cc1,C1CCCCC1,350.0
COc1ccc(/C=C/c2nc3ccccc3s2)cc1,CO,350.0
COc1ccc(/C=C/c2nc3cnccn3c2NC2CCCCC2)cc1,CS(C)=O,365.0
COc1ccc(/C=C/c2ncc(-c3ccccc3)o2)cc1OC,ClCCl,355.0
COc1ccc(/C=C/c2nccc3ccccc23)cc1,ClC(Cl)Cl,360.0
COc1ccc(/C=C/c2nccc3ccccc23)cc1,ClCCl,360.0
COc1ccc(/C=C2\OC(=O)c3ccccc32)cc1,CC#N,336.0
COc1ccc(/C=N/N=C/c2ccc(OC)cc2O)c(O)c1,C1CCOC1,368.0
COc1ccc(/C=N/N=C/c2ccc(OC)cc2OCC(=O)c2ccccc2)c(OCC(=O)c2ccccc2)c1,C1CCOC1,356.0
COc1ccc(/C=N/N=C/c2ccc(OC)cc2OCc2cc(=O)oc3cc(OC)ccc23)c(OCc2cc(=O)oc3cc(OC)ccc23)c1,C1CCOC1,321.0
COc1ccc(/C=c2\o/c(=C\c3ccc(N(C)C)cc3)c3cc(OC)c(OC)cc23)cc1,ClCCl,409.0
COc1ccc(/C=c2\o/c(=C\c3ccc(N(C)C)cc3)c3ccccc23)cc1,ClCCl,407.0
COc1ccc(/C=c2\o/c(=C\c3ccccc3)c3ccccc23)c(OC)c1,ClCCl,386.0
COc1ccc(/C=c2\o/c(=C\c3ccccc3)c3ccccc23)cc1,ClCCl,376.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,C1CCOC1,449.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,CC(C)=O,451.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,CCOC(C)=O,446.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,CO,448.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,CS(C)=O,447.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,Cc1ccccc1,449.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,ClCCl,451.0
COc1ccc(/N=N/c2c(O)c3ccccc3n(C)c2=O)c(S(=O)(=O)O)c1,O,447.0
COc1ccc(Br)cc1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,561.0
COc1ccc(C#CC2=C3CCc4ccccc4C3=[O+][B-](F)(F)O2)cc1,ClCCl,446.0
COc1ccc(C#Cc2c(C#Cc3ccc(OC)cc3)c(C#Cc3ccc(OC)cc3)c(C#Cc3ccc(OC)cc3)c(C#Cc3ccc(OC)cc3)c2C#Cc2ccc(OC)cc2)cc1,ClCCl,386.0
COc1ccc(C#Cc2c(F)c(F)c(C#Cc3ccc(OC)cc3)c(F)c2F)cc1,ClCCl,362.0
COc1ccc(C#Cc2c3cc4cc(C)sc4cc3c(C#Cc3ccc(OC)cc3)c3cc4cc(C)sc4cc23)cc1,ClCCl,573.0
COc1ccc(C#Cc2c3cc4ccccc4cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc4ccccc4cc23)cc1,ClCCl,655.0
COc1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(OC)cc3)c3cc4c(cc23)-c2ccccc2C4(C)C)cc1,ClCCl,486.0
COc1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(OC)cc3)c3cc4ccccc4cc23)cc1,ClCCl,559.0
COc1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(OC)cc3)c3cc4sc(C)cc4cc23)cc1,ClCCl,520.0
COc1ccc(C#Cc2c3ccccc3c(C#Cc3ccc(OC)cc3)c3ccccc23)cc1,ClCCl,473.0
COc1ccc(C#Cc2c3ccccc3c3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc1,CCCCCC,611.0
COc1ccc(C#Cc2c3ccccc3c3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc1,CCCCCCCCO,615.0
COc1ccc(C#Cc2c3ccccc3c3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc1,CCOC(C)=O,610.0
COc1ccc(C#Cc2c3ccccc3c3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc1,CN(C)C=O,615.0
COc1ccc(C#Cc2c3ccccc3c3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)cc1,ClCCl,616.0
COc1ccc(C#Cc2cc(C#Cc3ccc(OC)cc3)c(C#Cc3ccc(OC)cc3)c(C#Cc3ccc(OC)cc3)c2C#Cc2ccc(OC)cc2)cc1,ClCCl,380.0
COc1ccc(C#Cc2cc(C#Cc3ccc(OC)cc3)nc(C#Cc3ccc(OC)cc3)n2)cc1,ClC(Cl)Cl,335.0
COc1ccc(C#Cc2cc(C#N)c(C#Cc3ccccc3)cc2C#N)cc1,ClC(Cl)Cl,395.0
COc1ccc(C#Cc2cc3ccccc3oc2=O)cc1,CC#N,353.0
COc1ccc(C#Cc2ccc(-c3c(F)c(F)c(-c4ccc(C#Cc5ccc(OC)cc5)cc4)c(F)c3F)cc2)cc1,ClCCl,330.0
COc1ccc(C#Cc2ccc(-c3nn[nH]n3)cc2)cc1OC,C1CCOC1,324.0
COc1ccc(C#Cc2ccc(-c3nn[nH]n3)cc2)cc1OC,C1COCCO1,321.0
COc1ccc(C#Cc2ccc(-c3nn[nH]n3)cc2)cc1OC,CC#N,315.0
COc1ccc(C#Cc2ccc(-c3nn[nH]n3)cc2)cc1OC,CCOC(C)=O,321.0
COc1ccc(C#Cc2ccc(-c3nn[nH]n3)cc2)cc1OC,CS(C)=O,318.0
COc1ccc(C#Cc2ccc(-c3nn[nH]n3)cc2)cc1OC,Cc1ccccc1,323.0
COc1ccc(C#Cc2ccc(C#Cc3cc(C#N)ccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,368.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,C1CCOC1,369.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,CC#N,364.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,CN(C)C=O,369.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,ClC(Cl)Cl,371.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,c1ccccc1,371.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(OC)c(OC)c3)c3nsnc23)cc1OC,ClCCl,445.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,C1CCCCC1,333.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,C1COCCO1,333.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,CC#N,331.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,CCO,333.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,CS(C)=O,336.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,ClC(Cl)Cl,335.0
COc1ccc(C#Cc2ccc(C#Cc3ccc(P(=O)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,ClCCl,334.0
COc1ccc(C#Cc2ccc(C#Cc3ccccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,359.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,C1COCCO1,330.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,CC#N,324.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,CCCCCC,331.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,CCCCCCC,332.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,CCCO,328.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,CCOC(C)=O,328.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,CS(C)=O,329.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,ClC(Cl)Cl,332.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1,ClCCl,330.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,C1COCCO1,326.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,CC#N,325.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,CCCCCC,343.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,CCCCCCC,344.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,CCCO,329.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,CCOC(C)=O,326.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,CS(C)=O,334.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,ClC(Cl)Cl,329.0
COc1ccc(C#Cc2ccc(C#N)cc2)cc1OC,ClCCl,331.0
COc1ccc(C#Cc2ccc(N(c3ccc(C#Cc4ccc(C=C(C#N)C(=O)O)cc4)cc3)c3ccc(C#Cc4ccc(/C=C(/C#N)C(=O)O)cc4)cc3)cc2)cc1,ClC(Cl)Cl,350.0
COc1ccc(C#Cc2ccc3ccc(=O)oc3c2)cc1,CC#N,308.0
COc1ccc(C#Cc2ccc3nc4ccc(C#Cc5ccc(OC)cc5)cn4c(=O)c3c2)cc1,ClCCl,385.0
COc1ccc(C#Cc2cccc(-c3cccc(C#Cc4ccc(OC)s4)n3)n2)s1,CC#N,349.0
COc1ccc(C#Cc2ccccc2C#Cc2ccc(OC)cc2)cc1,CC#N,320.0
COc1ccc(C#Cc2nc(C#Cc3ccc(OC)cc3)c(C#Cc3ccc(OC)cc3)c(C#Cc3ccc(OC)cc3)c2C#Cc2ccc(OC)cc2)cc1,ClCCl,421.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2ccn(-c3ccccc3)c2)cc1,ClCCl,393.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,C1CCOC1,408.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,CC#N,407.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,CC(C)=O,408.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,CC(C)O,415.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,CCO,415.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,CCOC(C)=O,405.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,CO,415.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,Cc1ccccc1,407.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2cn(C)c3ccccc23)cc1,ClCCl,408.0
COc1ccc(C#Cc2nc3ccccc3nc2-c2csc(OC)c2)cc1,ClCCl,410.0
COc1ccc(C(=Cc2ccc(-c3ccc(-c4nnc(-c5ccc(N(c6ccc(C(C)(C)C)cc6)c6ccc(C(C)(C)C)cc6)cc5)s4)s3)s2)C(=O)O)cc1,ClC(Cl)Cl,444.0
COc1ccc(C(=Cc2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,421.0
COc1ccc(C(=Cc2ccc(/C=C(\C#N)c3ccccc3)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,388.0
COc1ccc(C(=Cc2ccc(/C=C/c3ccc(C#N)cc3)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,379.0
COc1ccc(C(=Cc2ccc(C#N)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,350.0
COc1ccc(C(=Cc2ccc(C=O)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,356.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,C1CCOC1,403.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,CC#N,412.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,CC(=O)O,426.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,CC(C)=O,408.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,CCO,419.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,CN(C)C=O,416.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,CO,421.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,Cc1ccccc1,404.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,ClC(Cl)Cl,417.0
COc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1OC,c1ccccc1,406.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,C1COCCO1,337.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CC#N,335.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CC(C)(C)O,345.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CC(C)O,345.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CCCCO,345.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CCOC(C)=O,339.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CN(C)C=O,344.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CO,343.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,ClCCl,339.0
COc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,O,347.0
COc1ccc(C(=O)COc2c(C)c(=O)n3c(=O)c(C)c(COC(=O)c4ccccc4Cl)n23)cc1,CCO,382.0
COc1ccc(C(=O)NC(C)(C)C)c2c1ccc1c3ccccc3c3ccccc3c12,ClCCl,334.0
COc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CC#N,368.0
COc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CC(C)=O,366.0
COc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CCCCCO,376.0
COc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CO,376.0
COc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,ClC(Cl)Cl,366.0
COc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,ClCCl,370.0
COc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,430.0
COc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1C(F)(F)F,CS(C)=O,431.0
COc1ccc(C(=O)OCc2c(C)c(=O)n3c(=O)c(C)c(C)n23)cc1,CCO,377.0
COc1ccc(C(=O)OCc2ccc3c4cccc5cccc(c6cccc2c63)c54)cc1,CCO,439.0
COc1ccc(C(=O)SCCC[Si](OC)(OC)OC)cc1,ClC(Cl)Cl,282.0
COc1ccc(C(=O)[O-])c(O)c1,CO,298.0
COc1ccc(C(=O)[O-])c(O)c1,O,292.0
COc1ccc(C(=O)c2c(C)c3ccc4cccc5c6cccc7ccc2c(c76)c3c45)cc1,ClCCl,391.0
COc1ccc(C(C#N)=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCCCC1,402.0
COc1ccc(C)cc1-c1cc2c3c(ccc4c3c1OC(c1ccccc1)=C4c1ccccc1)C(c1ccccc1)=C(c1ccccc1)O2,ClCCl,498.0
COc1ccc(C)cc1C1=C2C=CC(=[N+](C)C)C=C2[Si](C)(C)c2cc(N(C)C)ccc21,O,649.0
COc1ccc(C2(c3ccc(N(c4ccc(C5(c6ccc(OC)cc6)c6ccccc6-c6ccccc65)c(OC)c4)c4ccc(C5(c6ccc(OC)cc6)c6ccccc6-c6ccccc65)c(OC)c4)cc3OC)c3ccccc3-c3ccccc32)cc1,C1CCOC1,310.0
COc1ccc(C2(c3ccc(N(c4ccc(C5(c6ccc(OC)cc6)c6ccccc6-c6ccccc65)cc4OC)c4ccc(C5(c6ccc(OC)cc6)c6ccccc6-c6ccccc65)cc4OC)c(OC)c3)c3ccccc3-c3ccccc32)cc1,C1CCOC1,310.0
COc1ccc(C2=C(Br)C(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(OC)cc4)c(Br)c(-c4ccccc4)n2[B-]3(F)F)cc1,Cc1ccccc1,654.0
COc1ccc(C2=C(C)C3=C(c4c(-c5ccccn5)nc5ccccn45)c4c(C)c(-c5ccc(OC)cc5)c(C)n4[B-](F)(F)[N+]3=C2C)cc1,ClCCl,555.0
COc1ccc(C2=C(c3ccc(C)cc3)C(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(OC)cc4)c(-c4ccc(C)cc4)c(-c4ccccc4)n2[B-]3(F)F)cc1,Cc1ccccc1,656.0
COc1ccc(C2=C(c3ccc(F)cc3)C(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(OC)cc4)c(-c4ccc(F)cc4)c(-c4ccccc4)n2[B-]3(F)F)cc1,Cc1ccccc1,653.0
COc1ccc(C2=C(c3ccc(OC)cc3)C(C)(C)c3c2ccc2ccccc32)cc1,C1CCCCC1,336.0
COc1ccc(C2=C(c3ccc(OC)cc3)C(C)(C)c3cc(OC)ccc32)cc1,C1CCCCC1,296.0
COc1ccc(C2=C(c3ccc(OC)cc3)C(C)(C)c3ccccc32)cc1,C1CCCCC1,283.0
COc1ccc(C2=C(c3ccc(OC)cc3)C(C)(C)c3sccc32)cc1,C1CCCCC1,296.0
COc1ccc(C2=C(c3ccc(OC)cc3)C(c3ccc(OC)cc3)=[N+]3C2=C(c2ccc(OC)cc2)c2c(-c4ccc(OC)cc4)c(-c4ccc(OC)cc4)c(-c4ccc(OC)cc4)n2[B-]3(F)F)cc1,C1CCOC1,597.0
COc1ccc(C2=C(c3ccc(OC)cc3)C3(c4ccccc42)c2ccccc2-c2ccccc23)cc1,C1CCCCC1,314.0
COc1ccc(C2=C(c3ccc(OC)cc3)C3=Cc4ccccc4NB3OB3Nc4ccccc4C=C32)cc1,ClCCl,413.0
COc1ccc(C2=C(c3ccc(OC)cc3)N3C(=C(c4ccc(OC)cc4)c4cc([N+](=O)[O-])cc5c(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)[o+]c3c45)c3ccc(OC)cc32)cc1,ClCCl,587.0
COc1ccc(C2=C(c3ccc(OC)cc3)[Si](c3ccccc3)(c3ccccc3)c3ccccc32)cc1,C1CCOC1,341.0
COc1ccc(C2=C(c3ccc(OC)cc3)c3cc([N+](=O)[O-])cc4c(-c5ccc(OC)cc5)c5c6ccc(OC)cc6c(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)[n+]5c(c34)O2)cc1,ClCCl,587.0
COc1ccc(C2=C(c3ccc(OC)cc3)c3cccc4c(-c5ccc(OC)cc5)c5c6ccc(OC)cc6c(-c6ccc(OC)cc6)c(-c6ccc(OC)cc6)[n+]5c(c34)O2)cc1,ClCCl,492.0
COc1ccc(C2=C(c3ccc(OC)cc3)c3cccc4c3c(cc3nc5ccccc5nc34)O2)cc1,ClCCl,500.0
COc1ccc(C2=C(c3ccc(OC)cc3)c3cccc4c5c(cc(c34)O2)=NC(C#N)C(C#N)N=5)cc1,ClCCl,511.0
COc1ccc(C2=C(c3ccc(OC)cc3)c3cccc4c5c(cc(c34)O2)=NC2C=C(Br)C(Br)=CC2N=5)cc1,ClCCl,526.0
COc1ccc(C2=C(c3ccc(OC)cc3)c3ccccc3B3C2=Cc2ccc(C)cc2N3Cc2ccccc2)cc1,ClCCl,396.0
COc1ccc(C2=C/C(=C\c3ccc(C#N)cc3)C(=O)N2)cc1OC,C1COCCO1,457.0
COc1ccc(C2=C/C(=C\c3ccc(C#N)cc3)C(=O)O2)cc1OC,C1COCCO1,428.0
COc1ccc(C2=C/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)N2CC(C)C)cc1,C1COCCO1,465.0
COc1ccc(C2=C/C(=C\c3ccccc3)C(=O)O2)cc1OC,C1COCCO1,406.0
COc1ccc(C2=C3C(/C=C/c4cc(OC)c(OC)c(OC)c4)=C(C=O)C(/C=C/c4cc(OC)c(OC)c(OC)c4)=[N+]3[B-](F)(F)n3c(/C=C/c4cc(OC)c(OC)c(OC)c4)c(C=O)c(C=Cc4cc(OC)c(OC)c(OC)c4)c32)cc1,ClCCl,688.0
COc1ccc(C2=C3C(/C=C/c4cc(OC)c(OC)c(OC)c4)=C(C=O)C(C)=[N+]3[B-](F)(F)n3c(C)c(C=O)c(C=Cc4cc(OC)c(OC)c(OC)c4)c32)cc1,ClCCl,576.0
COc1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,Cc1ccccc1,504.0
COc1ccc(C2=C3C(C)=CC(C=Cc4ccc(C(=O)OC5C[C@H]6CCC5(C)C6(C)C)cc4)=[N+]3[B-](F)(F)n3c(/C=C/c4ccc(C(=O)OC5CC6CCC5(C)C6(C)C)cc4)cc(C)c32)cc1,Cc1ccccc1,640.0
COc1ccc(C2=C3C(C)=CC(C=Cc4ccc(C(=O)OC5C[C@H]6CCC5(C)C6(C)C)cc4)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1,Cc1ccccc1,568.0
COc1ccc(C2=C3C=C(/C=C/C(=O)OC(C)(C)C)C=[N+]3[B-](F)(F)n3cccc32)cc1,ClCCl,536.0
COc1ccc(C2=C3C=C(c4cc(OC)c(OC)cc4[N+](=O)[O-])C=[N+]3[B-](F)(F)n3cc(-c4cc(OC)c(OC)cc4[N+](=O)[O-])cc32)cc1,ClCCl,542.0
COc1ccc(C2=C3C=C(c4cc(OC)c(OC)cc4[N+](=O)[O-])C=[N+]3[B-](F)(F)n3cccc32)cc1,ClCCl,517.0
COc1ccc(C2=C3C=CC(=[N+](C)C)C=C3[Si](C)(C)c3cc(N(C)C)ccc32)c(C)c1,O,648.0
COc1ccc(C2=C3C=CC(=[N+](C)C)C=C3[Si](C)(C)c3cc(N(C)C)ccc32)c(OC)c1,O,649.0
COc1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,C1CCCCC1,510.0
COc1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,C1CCOC1,508.0
COc1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,CC#N,505.0
COc1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,CCOC(C)=O,507.0
COc1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,CO,506.0
COc1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,Cc1ccccc1,512.0
COc1ccc(C2=C3C=CC(C)=[N+]3[B-](F)(F)n3c(C)ccc32)cc1,ClC(Cl)Cl,511.0
COc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cc(-c4cc(OC)c(OC)cc4[N+](=O)[O-])cc32)cc1,ClCCl,517.0
COc1ccc(C2=C3C=c4c(oc5cc6c(cc45)[C@H]4CC[C@]5(C)C(=O)CC[C@H]5[C@@H]4CC6)=[N+]3[B-](F)(F)n3c2cc2c4cc5c(cc4oc23)CC[C@@H]2[C@@H]5CC[C@]3(C)C(=O)CC[C@@H]23)cc1,CCOC(C)=O,596.5
COc1ccc(C2=C3C=c4c(oc5cc6c(cc45)[C@H]4CC[C@]5(C)C(=O)CC[C@H]5[C@@H]4CC6)=[N+]3[B-](F)(F)n3c2cc2c4cc5c(cc4oc23)CC[C@@H]2[C@@H]5CC[C@]3(C)C(=O)CC[C@@H]23)cc1,CCOCC,596.5
COc1ccc(C2=C3C=c4c(oc5cc6c(cc45)[C@H]4CC[C@]5(C)C(=O)CC[C@H]5[C@@H]4CC6)=[N+]3[B-](F)(F)n3c2cc2c4cc5c(cc4oc23)CC[C@@H]2[C@@H]5CC[C@]3(C)C(=O)CC[C@@H]23)cc1,CO,595.5
COc1ccc(C2=CC(c3cc(OC)cc(OC)c3)=[O+][B-](F)(F)O2)cc1,ClCCl,396.0
COc1ccc(C2=CC(c3ccc(OC)cc3)=[O+][B-](C(C)=O)(C(C)=O)O2)cc1,CC#N,410.0
COc1ccc(C2=CC(c3ccc(OC)cc3)=[O+][B-](C(C)=O)(C(C)=O)O2)cc1,ClC(Cl)(Cl)Cl,405.0
COc1ccc(C2=CC(c3ccc4cc(N(C)C)ccc4c3)=[O+][B-](F)(F)O2)cc1,C1CCOC1,486.0
COc1ccc(C2=CC(c3ccc4cc(N(C)C)ccc4c3)=[O+][B-](F)(F)O2)cc1,CC#N,496.0
COc1ccc(C2=CC(c3ccc4cc(N(C)C)ccc4c3)=[O+][B-](F)(F)O2)cc1,CC(C)=O,492.0
COc1ccc(C2=CC(c3ccc4cc(N(C)C)ccc4c3)=[O+][B-](F)(F)O2)cc1,CS(C)=O,512.0
COc1ccc(C2=CC(c3ccc4cc(N(C)C)ccc4c3)=[O+][B-](F)(F)O2)cc1,Cc1ccccc1,484.0
COc1ccc(C2=CC(c3ccc4cc(N(C)C)ccc4c3)=[O+][B-](F)(F)O2)cc1,ClC(Cl)Cl,494.0
COc1ccc(C2=CC(c3ccc4cc(N(C)C)ccc4c3)=[O+][B-](F)(F)O2)cc1,ClCCl,499.0
COc1ccc(C2=CC(c3ccc4ccccc4c3)=[O+][B-](C(C)=O)(C(C)=O)O2)cc1,CC#N,411.0
COc1ccc(C2=CC(c3ccc4ccccc4c3)=[O+][B-](C(C)=O)(C(C)=O)O2)cc1,ClC(Cl)(Cl)Cl,413.0
COc1ccc(C2=CC(c3ccccc3)=C(c3ccccc3)C2)c2ccccc12,ClCCl,354.0
COc1ccc(C2=CC(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(OC)cc4)cc(-c4ccccc4)n2[B-]3(F)F)cc1,Cc1ccccc1,663.0
COc1ccc(C2=CC(c3ccccc3)=[N+]3C2=Nc2c(-c4ccc(OC)cc4)cc(-c4ccccc4)n2[B-]3(F)F)cc1,ClC(Cl)Cl,664.0
COc1ccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(OC)cc2)cc1,C1CCCCC1,621.0
COc1ccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(OC)cc2)cc1,C1CCOC1,621.0
COc1ccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(OC)cc2)cc1,CC#N,608.0
COc1ccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(OC)cc2)cc1,Cc1ccccc1,625.0
COc1ccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)n4[B-](F)(F)[N+]3=C2c2ccc(OC)cc2)cc1,ClCCl,616.0
COc1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,444.0
COc1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,410.5
COc1ccc(C2=Cc3cc4ccccc4cc3P2(=O)c2ccccc2)cc1,ClCCl,395.0
COc1ccc(C2=Cc3ccc4ccccc4[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,439.0
COc1ccc(C2=Cc3ccccc3P2(=O)c2ccccc2)cc1,C1CCOC1,362.0
COc1ccc(C2=Cc3ccccc3P2(=O)c2ccccc2)cc1,ClCCl,365.0
COc1ccc(C2=Cc3ccccc3[Si]2(c2ccccc2)c2ccccc2)cc1,ClCCl,350.0
COc1ccc(C2=N/C(=C\c3ccc(C#N)cc3)C(=O)N2)cc1OC,C1COCCO1,405.0
COc1ccc(C2=N/C(=C\c3ccc(C#N)cc3)C(=O)O2)cc1OC,C1COCCO1,393.0
COc1ccc(C2=N/C(=C\c3ccccc3)C(=O)N2)cc1OC,C1COCCO1,390.0
COc1ccc(C2=N/C(=C\c3ccccc3)C(=O)O2)cc1OC,C1COCCO1,378.0
COc1ccc(C2=NN(c3cccc(S(=O)(=O)c4cccc(N5N=C(c6ccc(OC)cc6)CC5c5ccc(OC)cc5)c4)c3)C(c3ccc(OC)cc3)C2)cc1,ClCCl,345.0
COc1ccc(C2=Nc3cccc4[n+]3[B-](F)(O2)OC(c2ccc(OC)cc2)=N4)cc1,ClCCl,399.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(-c5ccc(C#N)cc5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2c2ccc(C#N)cc2)cc1,C1CCOC1,618.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(-c5ccc(C#N)cc5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2c2ccc(C#N)cc2)cc1,CC#N,606.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(-c5ccc(C#N)cc5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2c2ccc(C#N)cc2)cc1,Cc1ccccc1,626.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(-c5cccs5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2c2cccs2)cc1,C1CCOC1,645.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(-c5cccs5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2c2cccs2)cc1,CC#N,635.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(-c5cccs5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2c2cccs2)cc1,Cc1ccccc1,653.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(Cl)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2Cl)cc1,C1CCOC1,597.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(Cl)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2Cl)cc1,CC#N,587.0
COc1ccc(C2=[N+]3C(=C(c4ccc(C#N)cc4)c4cc(Cl)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2Cl)cc1,Cc1ccccc1,609.0
COc1ccc(C2=[N+]3C(=C(c4ccc(I)cc4)c4ccc(-c5ccc(OC)cc5)n4[B-]3(F)F)C=C2)cc1,ClC(Cl)Cl,582.0
COc1ccc(C2=[N+]3C(=Cc4c(C)c(CCC(=O)NCCCCCC(=O)ON5C(=O)CCC5=O)c(C)n4[B-]3(F)F)C=C2)cc1,CO,544.0
COc1ccc(C2=[N+]3C(=Cc4c5ccc(OC)cc5c(-c5ccc(OC)cc5)n4[B-]3(F)F)c3ccc(OC)cc32)cc1,ClCCl,673.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5cc(OC)c(OC)c(OC)c5)c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3cc(OC)c(OC)c(OC)c3)=C2c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,694.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5cc(OC)c(OC)c(OC)c5)c(Br)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3cc(OC)c(OC)c(OC)c3)=C2Br)cc1,Cc1ccccc1,689.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5cc(OC)c(OC)c(OC)c5Br)c(-c5ccc(C(C)(C)C)cc5)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3cc(OC)c(OC)c(OC)c3Br)=C2c2ccc(C(C)(C)C)cc2)cc1,Cc1ccccc1,706.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccc6ccccc6c5)c(Br)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3ccc4ccccc4c3)=C2Br)cc1,ClCCl,692.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccc6ccccc6c5)cc(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3ccc4ccccc4c3)=C2)cc1,ClCCl,704.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)c(Br)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2Br)cc1,ClC(Cl)Cl,679.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)c(Br)c(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2Br)cc1,ClCCl,679.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)c5c(n4[B-]3(F)F)-c3ccc(OC)cc3CC5)C(c3ccccc3)=C2)cc1,ClC(Cl)Cl,708.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)cc(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2)cc1,ClC(Cl)Cl,688.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)cc(-c5ccc(OC)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2)cc1,ClCCl,688.0
COc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5-c5ccc(C(C)(C)C)cc5)cc(-c5ccc(OC)cc5)n4[B-]3(F)F)c3c2c2cc(C(C)(C)C)ccc2c2ccccc32)cc1,Cc1ccccc1,701.0
COc1ccc(C2=[N+]3C(=Nc4c(C)cc(-c5ccc(OC)cc5)n4[B-]3(F)F)C(C)=C2)cc1,CS(C)=O,656.0
COc1ccc(C2=[N+]3C(=Nc4c5c6cc(OC)c(OC)c(OC)c6c6cc(C(C)(C)C)ccc6c5c(-c5ccc(OC)cc5)n4[B-]3(F)F)c3c2c2ccc(C(C)(C)C)cc2c2c(OC)c(OC)c(OC)cc32)cc1,Cc1ccccc1,745.0
COc1ccc(C2=[N+]3C(=Nc4c5c6ccccc6c6ccc(C(C)(C)C)cc6c5c(-c5ccc(OC)cc5)n4[B-]3(F)F)c3c2c2cc(C(C)(C)C)ccc2c2ccccc32)cc1,Cc1ccccc1,716.0
COc1ccc(C2=[N+]3C(=Nc4c5ccccc5c(-c5ccc(OC)cc5)n4[B-]3(F)F)c3ccccc32)cc1,ClCCl,729.0
COc1ccc(C2=[O+][B-](F)(F)OC(c3ccc4c(c3)Cc3ccccc3-4)=C2)cc1,CC#N,424.0
COc1ccc(C2=c3sc(-c4ccc(OC)cc4)c(-c4ccc(OC)cc4)c3=[N+]3C2=Nc2c(-c4ccc(OC)cc4)c4sc(-c5ccc(OC)cc5)c(-c5ccc(OC)cc5)c4n2[B-]3(F)F)cc1,ClC(Cl)Cl,784.0
COc1ccc(C2=c3sc(-c4ccc(OC)cc4)cc3=[N+]3C2=Nc2c(-c4ccc(OC)cc4)c4sc(-c5ccc(OC)cc5)cc4n2[B-]3(F)F)cc1,ClC(Cl)Cl,788.0
COc1ccc(C2C3=C(CCCC3=O)Nc3c2c(=O)oc2ccccc32)cc1,CS(C)=O,361.0
COc1ccc(C2CC(c3ccc(Cl)cc3)=NN2c2cccc(S(=O)(=O)c3cccc(N4N=C(c5ccc(Cl)cc5)CC4c4ccc(OC)cc4)c3)c2)cc1,ClCCl,361.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,C1CCOC1,359.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,C1COCCO1,360.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,CC#N,358.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,CC(C)O,358.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,CCO,358.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,CCOC(C)=O,358.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,CN(C)C=O,361.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,CO,357.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,CS(C)=O,364.0
COc1ccc(C2CC(c3ccc(O)cc3)=NN2c2ccc(S(N)(=O)=O)cc2)cc1,O,360.0
COc1ccc(C2N=C(c3ccc(N(c4ccccc4)c4ccc(C=C(C#N)C(=O)O)cc4)cc3)NC2c2ccc(OC)cc2)cc1,CCO,405.0
COc1ccc(C=C(C#N)c2ccc3c(OC)c(C(C#N)=Cc4ccc(OC)cc4)ccc3c2OC)cc1,ClCCl,404.0
COc1ccc(C=C(C#N)c2ccc3c(c2)c2cc(C(C#N)=Cc4ccc(OC)cc4)ccc2n3C)cc1,ClCCl,399.0
COc1ccc(C=CC(=O)c2nnn(-c3ccnc4cc(Cl)ccc34)c2C)cc1,CO,233.0
COc1ccc(C=CC(=O)c2nnn(-c3ccnc4cc(Cl)ccc34)c2C)cc1OC,CO,236.0
COc1ccc(C=Cc2cc(C=Cc3ccc(OC)cc3)nc(C#Cc3ccc(N(c4ccc(C#Cc5nc(C=Cc6ccc(OC)cc6)cc(C=Cc6ccc(OC)cc6)n5)cc4)c4ccc(C#Cc5nc(C=Cc6ccc(OC)cc6)cc(C=Cc6ccc(OC)cc6)n5)cc4)cc3)n2)cc1,ClCCl,376.0
COc1ccc(C=Cc2ccc(O)c(C=NCCN(C)C)c2)cc1,CS(C)=O,318.0
COc1ccc(C=Cc2ccc3cc(F)c(F)c(O)c3n2)cc1,CC#N,352.0
COc1ccc(C=Cc2ccn3cc(-c4ccc(OC)cc4)nc3c2)cc1,Cc1ccccc1,387.0
COc1ccc(C=Cc2ccn3cc(-c4ccccc4)nc3c2)cc1,Cc1ccccc1,384.0
COc1ccc(C=Cc2ccncc2)cc1C=NCCN(C)C,CS(C)=O,321.0
COc1ccc(C=Cc2sc(C=C(C#N)c3cccs3)c3c2OCCO3)cc1,ClCCl,460.0
COc1ccc(C=NCCN=Cc2ccc(OC)cc2)cc1,ClCCl,256.0
COc1ccc(C=[N+]([O-])c2ccccc2)cc1,CCO,660.0
COc1ccc(CCC(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,429.0
COc1ccc(CCn2c(Nc3cc(Cl)cc(Cl)c3)nc3cc4c(C)c(C(N)=O)c(=O)oc4cc32)cc1,CCO,363.0
COc1ccc(CN(C(=O)c2ccc(C3=C4C=CC=[N+]4[B-](F)(F)n4cccc43)cc2)C(C(=O)NC(C)(C)C)c2ccccc2)cc1,C1CCOC1,502.0
COc1ccc(CNc2ncnc3[nH]c(C=Cc4ccc(C(F)(F)F)cc4)nc23)cc1,CS(C)=O,360.0
COc1ccc(Cc2nnc3sc(-c4ccc(-c5ccc(-c6ccccc6)cc5)cc4)nn23)cc1,CS(C)=O,263.0
COc1ccc(Cc2nnc3sc(-c4ccc(-c5ccccc5)cc4)nn23)cc1,CS(C)=O,300.0
COc1ccc(Cc2nnc3sc(-c4ccc5ccccc5c4)nn23)cc1,CO,306.0
COc1ccc(Cl)cc1-c1cc2c3c(ccc4c3c1OC(c1ccccc1)=C4c1ccccc1)C(c1ccccc1)=C(c1ccccc1)O2,ClCCl,496.0
COc1ccc(Cn2c(Nc3ccc(I)cc3)nc3cc4c(C)c(C(N)=O)c(=O)oc4cc32)c(OC)c1,CCO,362.0
COc1ccc(F)cc1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,561.0
COc1ccc(N(/C=C/c2ccc([N+](=O)[O-])cc2)c2ccc(OC)cc2)cc1,Cc1ccccc1,445.0
COc1ccc(N(c2ccc(-c3ccc(C=C(C#N)C(=O)O)o3)cc2)c2ccc(OC)c(OC)c2)cc1OC,ClCCl,504.0
COc1ccc(N(c2ccc(/C=C(\C#N)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)c2ccc(OC)cc2)cc1,ClC(Cl)Cl,525.0
COc1ccc(N(c2ccc(/C=C(\C)c3ccccc3)cc2)c2ccc(/C=C(\C)c3ccccc3)cc2)cc1,Cc1ccccc1,364.0
COc1ccc(N(c2ccc(/C=C(\C)c3ccccc3)cc2)c2ccc(OC)cc2)cc1,Cc1ccccc1,347.0
COc1ccc(N(c2ccc(/C=C/c3cc[n+](CC(=O)O)cc3)cc2)c2ccc(OC)cc2)cc1,ClCCl,504.0
COc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)c2ccc(OC)cc2)cc1,ClCCl,475.0
COc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\C#N)c4ccncc4)cc3)cc2)c2ccc(OC)cc2)cc1,ClCCl,457.0
COc1ccc(N(c2ccc(/C=C/c3ccc(/C=C(\C#N)c4nn[nH]n4)cc3)cc2)c2ccc(OC)cc2)cc1,ClCCl,465.0
COc1ccc(N(c2ccc(/C=C/c3ccc(N(c4ccc(OC)cc4)c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)cc4)cc3)cc2)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2)cc1,CCO,478.0
COc1ccc(N(c2ccc(/C=C/c3ccc(Nc4ncc(C=C(C#N)C(=O)O)cn4)cc3)cc2)c2ccc(OC)cc2)cc1,Cc1ccccc1,385.0
COc1ccc(N(c2ccc(/C=C/c3ccc4c(c3)c3cc(/C=C(\C#N)C(=O)O)ccc3n4C)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,370.0
COc1ccc(N(c2ccc(/C=C/c3nc4ccc(C(=O)O)cc4nc3/C=C/c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc2)c2ccc(OC)cc2)cc1,ClC(Cl)Cl,483.0
COc1ccc(N(c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2ccc(/C=N/N(c3ccccc3)c3ccccc3)cc2)cc1,ClC(Cl)Cl,497.0
COc1ccc(N(c2ccc(C#C/C3=c4\cc/c5n4[Zn]n4c(ccc4/C(c4cc(C(C)(C)C)cc(C(C)(C)C)c4)=C4/C=CC3=N4)/C(C#Cc3ccc(C(=O)O)cc3)=C3/C=CC(=N3)/C=5c3cc(C(C)(C)C)cc(C(C)(C)C)c3)cc2)c2ccc(OC)cc2)cc1,C1CCOC1,672.0
COc1ccc(N(c2ccc(C#C/C=C(/C#N)C(=O)O)cc2)c2ccc(OC)cc2)cc1,ClC(Cl)Cl,440.0
COc1ccc(N(c2ccc(C#Cc3c4ccccc4c(-c4ccc(/C=C(\C#N)C(=O)O)cc4)c4ccccc34)cc2)c2ccc(OC)cc2)cc1,ClCCl,511.0
COc1ccc(N(c2ccc(C#Cc3cc(C#N)c(C#Cc4cc(C#N)ccc4C#N)cc3C#N)cc2)c2ccc(OC)cc2)cc1,ClC(Cl)Cl,498.0
COc1ccc(N(c2ccc(C#Cc3ccc(/C=C(\C#N)C(=O)O)s3)cc2)c2ccc(OC)cc2)cc1,ClC(Cl)Cl,475.0
COc1ccc(N(c2ccc(C)cc2)c2c([O-])/c(=[N+](\c3ccc(C)cc3)c3ccc(OC)cc3)c2=O)cc1,CN(C)C=O,418.0
COc1ccc(N(c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)cc1,Cc1ccccc1,397.0
COc1ccc(N(c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)c2ccc(OC)cc2)cc1,Cc1ccccc1,376.0
COc1ccc(N(c2ccc(C=Cc3ccc(/C=C/c4ccc(N(c5ccc(OC)cc5)c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)cc5)cc4)cc3)cc2)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2)cc1,CCO,480.0
COc1ccc(N(c2ccc(OC)cc2)c2c3ccccc3c(C#Cc3ccc(C(=O)O)cc3)c3ccccc23)cc1,C1CCOC1,498.0
COc1ccc(N(c2ccc(OC)cc2)c2cc(N(c3ccc(OC)cc3)c3ccc(OC)cc3)c3ccc4cc(C(C)(C)C)cc5ccc2c3c54)cc1,ClCCl,434.0
COc1ccc(N(c2ccc(OC)cc2)c2cc(OC)c(-c3cc4sc(/C=C(\C#N)C(=O)O)cc4s3)cc2OC)cc1,ClC(Cl)Cl,517.0
COc1ccc(N(c2ccc(OC)cc2)c2cc3ccc4cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5ccc(c2)c3c45)cc1,C1CCOC1,399.0
COc1ccc(N(c2ccc(OC)cc2)c2cc3ccc4cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5ccc(c2)c3c45)cc1,CC(C)=O,395.0
COc1ccc(N(c2ccc(OC)cc2)c2cc3ccc4cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5ccc(c2)c3c45)cc1,CCCCCC,398.0
COc1ccc(N(c2ccc(OC)cc2)c2cc3ccc4cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5ccc(c2)c3c45)cc1,Cc1ccccc1,402.0
COc1ccc(N(c2ccc(OC)cc2)c2cc3ccc4cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5ccc(c2)c3c45)cc1,ClC(Cl)Cl,399.0
COc1ccc(N(c2ccc(OC)cc2)c2cc3ccc4cc(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5ccc(c2)c3c45)cc1,ClCCl,397.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3c(C)c4n(c3C)[B-](F)(F)[N+]3=C(C)C(c5cc6sc(-c7cc[n+]([O-])cc7)cc6s5)=C(C)C3=C4C)cc2)cc1,ClC(Cl)Cl,535.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3c(C)c4n(c3C)[B-](F)(F)[N+]3=C(C)C(c5cc6sc(C=C(C#N)C(=O)O)cc6s5)=C(C)C3=C4C)cc2)cc1,ClC(Cl)Cl,541.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3c(C)c4n(c3C)[B-](F)(F)[N+]3=C(C)C(c5ccc(-c6cc[n+]([O-])cc6)s5)=C(C)C3=C4C)cc2)cc1,ClC(Cl)Cl,537.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3c(C)c4n(c3C)[B-](F)(F)[N+]3=C(C)C(c5ccc(C=C(C#N)C(=O)O)s5)=C(C)C3=C4C)cc2)cc1,ClC(Cl)Cl,545.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3c(C)c4n(c3C)[B-](F)(F)[N+]3=C(C)C(c5ccc(C=C(C#N)C(=O)O)s5)=C(C)C3=C4C)s2)cc1,ClC(Cl)Cl,535.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3c(C)c4n(c3C)[B-]3(Oc5ccccc5O3)[N+]3=C(C)C(c5ccc(C=C(C#N)C(=O)O)s5)=C(C)C3=C4C)cc2)cc1,ClC(Cl)Cl,545.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3c4ccccc4c(C#Cc4ccc(/C=C(\C#N)C(=O)O)s4)c4ccccc34)cc2)cc1,ClCCl,490.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3cc4sc(/C=C(\C#N)C(=O)O)cc4s3)cc2)cc1,ClC(Cl)Cl,512.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4cc5sc(C=C(C#N)C(=O)O)cc5s4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CN(C)C=O,481.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(N(c7ccc(OC)cc7)c7ccc(OC)cc7)cc6)s5)c5nsnc45)s3)cc2)cc1,ClC(Cl)Cl,545.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(-c5cccs5)c5nsnc45)s3)cc2)cc1,ClC(Cl)Cl,510.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)cc4)cc3)cc2)cc1,C1CCOC1,399.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)c4nsnc34)cc2)cc1,ClC(Cl)Cl,494.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)cc1,C1CCOC1,432.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,C1CCOC1,485.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)cc1,C1CCOC1,498.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)cc4)s3)cc2)cc1,C1CCOC1,451.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2)cc1,CN(C)C=O,477.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)c4nsnc34)cc2)cc1,ClC(Cl)Cl,494.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3)cc2)cc1,C1CCOC1,432.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4ccc(C=C5NC(=O)NC5=O)s4)c4nsnc34)cc2)cc1,ClC(Cl)Cl,515.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4sc(-c5ccc(C(C#N)C(=O)O)s5)c5c4OCC4(COc6c(-c7ccc(-c8ccc(N(c9ccc(OC)cc9)c9ccc(OC)cc9)cc8)s7)sc(-c7ccc(C(C#N)C(=O)O)s7)c6OC4)CO5)s3)cc2)cc1,CS(C)=O,482.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(-c4sc(C(C#N)C(=O)O)c5c4OCC4(COc6c(-c7ccc(-c8ccc(N(c9ccc(OC)cc9)c9ccc(OC)cc9)cc8)s7)sc(C(C#N)C(=O)O)c6OC4)CO5)s3)cc2)cc1,CS(C)=O,421.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)cc2)cc1,CC#N,501.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(C=C(C#N)C#N)o3)cc2)cc1,ClC(Cl)Cl,524.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(C=C(C#N)C#N)s3)cc2)cc1,ClC(Cl)Cl,525.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)c4nsnc34)s2)cc1,ClCCl,650.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)cn3)cc2)cc1,C1CCOC1,426.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)cc1,ClCCl,499.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3ccc4nc5ccccc5c(=O)n4c3)cc2)cc1,ClCCl,361.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3cnc(-c4ccc(C=C(C#N)C(=O)O)s4)c4nsnc34)cc2)cc1,ClCCl,585.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3nc4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)cc4s3)cc2)cc1,ClCCl,425.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3nc4ccc(-c5ccc(C=C(C#N)C(=O)O)o5)cc4s3)cc2)cc1,ClCCl,463.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3nc4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)cc4s3)cc2)cc1,ClCCl,460.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CC#N,402.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CCCCCC,402.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CO,402.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3sc(-c4ccc(C(C#N)C(=O)O)s4)c4c3OCC3(COc5c(-c6ccc(N(c7ccc(OC)cc7)c7ccc(OC)cc7)cc6)sc(-c6ccc(C(C#N)C(=O)O)s6)c5OC3)CO4)cc2)cc1,CS(C)=O,405.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3sc(/C=C(/C#N)C(=O)O)c(OC)c3OC)cc2)cc1,CS(C)=O,552.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3sc(/C=C(/C#N)C(=O)O)c4c3OC[C@@]3(CO4)COc4c(/C=C(\C#N)C(=O)O)sc(-c5ccc(N(c6ccc(OC)cc6)c6ccc(OC)cc6)c6nsnc56)c4OC3)c3nsnc23)cc1,CS(C)=O,555.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3sc(/C=C(/C#N)C(=O)O)c4c3OC[C@@]3(CO4)COc4c(/C=C(\C#N)C(=O)O)sc(-c5ccc(N(c6ccc(OC)cc6)c6ccc(OC)cc6)cc5)c4OC3)cc2)cc1,CS(C)=O,437.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(-c3sc(/C=C(\C#N)C(=O)O)c4c3OC[C@@]3(COc5c(/C=C(/C#N)C(=O)O)sc(-c6ccc(N(c7ccc(OC)cc7)c7ccc(OC)cc7)c7nsnc67)c5OC3)CO4)cc2)cc1,CS(C)=O,537.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(/C3=c4\cc/c5n4[Zn]n4c(ccc4/C(c4cc(C(C)(C)C)cc(C(C)(C)C)c4)=C4/C=CC3=N4)/C(C#Cc3ccc(C(=O)O)cc3)=C3/C=CC(=N3)/C=5c3cc(C(C)(C)C)cc(C(C)(C)C)c3)cc2)cc1,CCO,628.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)cc3)cc2)cc1,C1CCOC1,430.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc3c(c2)-c2cc(N(c4ccc(OC)cc4)c4ccc(OC)cc4)ccc2C3=Cc2ccc(C=C(C#N)C(=O)O)s2)cc1,ClCCl,548.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc3c(c2)C2(c4cc(N(c5ccc(OC)cc5)c5ccc(OC)cc5)ccc4C=C3)c3ccccc3-c3ccccc32)cc1,ClCCl,414.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc3c4cccc5c(N(c6ccc(OC)cc6)c6ccc(OC)cc6)ccc(c6cccc2c63)c54)cc1,C1CCCCC1,519.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc3c4cccc5c(N(c6ccc(OC)cc6)c6ccc(OC)cc6)ccc(c6cccc2c63)c54)cc1,C1CCOC1,515.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc3c4cccc5c(N(c6ccc(OC)cc6)c6ccc(OC)cc6)ccc(c6cccc2c63)c54)cc1,CC#N,508.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc3c4cccc5c(N(c6ccc(OC)cc6)c6ccc(OC)cc6)ccc(c6cccc2c63)c54)cc1,Cc1ccccc1,519.0
COc1ccc(N(c2ccc(OC)cc2)c2ccc3c4cccc5c(N(c6ccc(OC)cc6)c6ccc(OC)cc6)ccc(c6cccc2c63)c54)cc1,ClCCl,514.0
COc1ccc(N(c2ccc(OC)cc2)c2sc(-c3ccc(Cl)cc3)nc2-c2ccccc2)cc1,ClC(Cl)Cl,393.0
COc1ccc(N(c2ccccc2)c2cc3ccc4cc(N(c5ccccc5)c5ccc(OC)cc5)cc5ccc(c2)c3c45)cc1,Cc1ccccc1,453.0
COc1ccc(N(c2ccccc2)c2ccc(OC)cc2)cc1,Cc1ccccc1,300.0
COc1ccc(N(c2ccccc2)c2ccc3c(c2)c2cc(N(c4ccc(C=C(C#N)C(=O)O)cc4)c4ccc(OC)cc4)ccc2n3C)cc1,ClCCl,443.0
COc1ccc(N(c2ccccc2)c2ccc3ccc4c(N(c5ccccc5)c5ccc(OC)cc5)ccc5ccc2c3c54)cc1,ClCCl,432.0
COc1ccc(N2C(=O)c3ccccc3C2C(=O)OC(C)(C)C)cc1OC,CCCCCC,296.0
COc1ccc(N2C(=O)c3ccccc3C2C(=O)OC(C)(C)C)cc1OC,CO,296.0
COc1ccc(N2C(=O)c3ccccc3C2C(=O)OC(C)(C)C)cc1OC,CS(C)=O,302.0
COc1ccc(N2C(=O)c3ccccc3C2C(=O)OC(C)(C)C)cc1OC,ClCCl,300.0
COc1ccc(N2C(=O)c3ccccc3NC2C(C)(C)C)cc1,CC#N,348.0
COc1ccc(N2C(=O)c3ccccc3NC2C(C)(C)C)cc1,CO,355.0
COc1ccc(N2C(=O)c3ccccc3NC2C(C)(C)C)cc1,ClC(Cl)Cl,344.0
COc1ccc(N2C(=O)c3ccccc3NC2C(C)(C)C)cc1,c1ccccc1,342.0
COc1ccc(N2c3c(sc4ccccc34)Sc3sc4ccccc4c32)cc1,ClCCl,309.0
COc1ccc(N2c3cc(OC)ccc3N=c3cc4c(cc32)=Nc2cc(C(C)(C)C)cc(C(C)(C)C)c2O4)cc1,CC#N,539.0
COc1ccc(N2c3cc(OC)ccc3N=c3cc4c(cc32)=Nc2cc(C(C)(C)C)cc(C(C)(C)C)c2O4)cc1,CCCCCC,562.0
COc1ccc(N2c3cc(OC)ccc3N=c3cc4c(cc32)=Nc2cc(C(C)(C)C)cc(C(C)(C)C)c2O4)cc1,CO,558.0
COc1ccc(N2c3ccc(-c4cc5sc6cc(C=C(C#N)C(=O)O)sc6c5s4)cc3C3CCCC32)cc1,C1COCCO1,485.0
COc1ccc(N2c3ccc(-c4cc5sc6cc(C=C(C#N)C(=O)O)sc6c5s4)cc3C3CCCC32)cc1,CCO,485.0
COc1ccc(N2c3ccc(/C=C(/C#N)C(=O)O)cc3C3CCCC32)cc1,CCO,440.0
COc1ccc(N2c3ccc(/C=C(\C#N)C(=O)O)cc3Oc3cc(/C=C(\C#N)C(=O)O)ccc32)cc1,C1CCOC1,498.0
COc1ccc(N2c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)cc3C3CCCC32)cc1,CCO,483.0
COc1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4cc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,520.0
COc1ccc(N2c3ccccc3CCc3cc(C=C(C#N)C(=O)O)ccc32)cc1,CC#N,416.0
COc1ccc(N2c3ccccc3Oc3cc(-c4ccc(/C=C(\C#N)C(=O)O)o4)ccc32)cc1,ClCCl,508.0
COc1ccc(N2c3ccccc3Oc3cc(/C=C(\C#N)C(=O)O)ccc32)cc1,C1CCOC1,458.0
COc1ccc(N2c3ccccc3Sc3cc(C=C(C#N)C(=O)O)ccc32)cc1,ClCCl,476.0
COc1ccc(N2c3sc4ccccc4c3Sc3c2sc2ccccc32)cc1,ClCCl,425.0
COc1ccc(N2c3sc4ccccc4c3Sc3sc4ccccc4c32)cc1,ClCCl,319.0
COc1ccc(N=Nc2c(-c3ccccc3)[nH]c3c(N=Nc4ccccc4)c(C)nn23)cc1,C1COCCO1,526.0
COc1ccc(N=Nc2c(-c3ccccc3)[nH]c3ccccc23)cc1,CS(C)=O,405.0
COc1ccc(N=Nc2c(N)n3c(nc4ccccc43)[nH]c2=O)cc1,ClC(Cl)Cl,420.0
COc1ccc(N=Nc2nc3ccc([N+](=O)[O-])cc3s2)cc1,CO,407.0
COc1ccc(N=Nc2sc(N)nc2-c2ccc(NC(=O)c3ccccc3)cc2)cc1,CS(C)=O,487.0
COc1ccc(NC(=O)C(C(=O)Nc2ccc(OC)cc2)C(c2ccccc2O)c2c(C)[nH]c3ccccc23)cc1,CO,258.0
COc1ccc(NC(=O)C(C(=O)Nc2ccc(OC)cc2)C(c2ccccc2O)c2c(C)[nH]c3ccccc23)cc1,CS(C)=O,266.0
COc1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1,CCCCCC,458.0
COc1ccc(NC2=CC(=O)c3ccccc3C2=O)cc1,CO,479.0
COc1ccc(Nc2ccc3cc4c(c(C(C)=O)c3c2)CCC4)cc1,ClCCl,372.0
COc1ccc(Nc2nc(Nc3ccc(N)cc3)nc(Nc3ccc(OC)cc3)n2)cc1,ClCCl,283.0
COc1ccc(Nc2nc3cc4c(C)c(C(N)=O)c(=O)oc4cc3n2Cc2ccccc2)cc1,CCO,351.0
COc1ccc(O)c(-c2nc(C)c3n2CCCC3)c1,ClCCl,332.0
COc1ccc(O)c(C(=O)[O-])c1,CO,307.0
COc1ccc(O)c(C(=O)[O-])c1,O,319.0
COc1ccc(O)cc1C=O,CO,355.0
COc1ccc(O)cc1C=O,ClC(Cl)Cl,349.0
COc1ccc(OC)c(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)c1,CS(C)=O,429.0
COc1ccc(OC)c(C(=O)O)c1,CO,314.0
COc1ccc(OC)c(C2=C3C=CC(=[N+](C)C)C=C3[Si](C)(C)c3cc(N(C)C)ccc32)c1,O,651.0
COc1ccc(OC)c(C=O)c1,C1CCOC1,349.0
COc1ccc(OC)c(C=O)c1,C1COCCO1,348.0
COc1ccc(OC)c(C=O)c1,CC#N,349.0
COc1ccc(OC)c(C=O)c1,CC(C)=O,349.0
COc1ccc(OC)c(C=O)c1,CCCO,352.0
COc1ccc(OC)c(C=O)c1,CCO,352.0
COc1ccc(OC)c(C=O)c1,CN(C)C=O,351.0
COc1ccc(OC)c(C=O)c1,CN(C)P(=O)(N(C)C)N(C)C,352.0
COc1ccc(OC)c(C=O)c1,CNC=O,352.0
COc1ccc(OC)c(C=O)c1,CO,352.0
COc1ccc(OC)c(C=O)c1,CS(C)=O,353.0
COc1ccc(OC)c(C=O)c1,ClC(Cl)Cl,352.0
COc1ccc(OC)c(C=O)c1,NC=O,356.0
COc1ccc(OCc2nnc(-c3ccn4c(C)nc(Cl)c4c3)o2)cc1,CC#N,375.0
COc1ccc(O[B-]2(Oc3ccc(OC)cc3)n3c(C)cc(C)c3C(c3ccc(I)cc3)=C3C(C)=CC(C)=[N+]32)cc1,ClC(Cl)Cl,507.0
COc1ccc(Oc2ccc3c4c(cccc24)C(=O)N(c2c(C(C)C)cccc2C(C)C)C3=O)cc1,ClCCl,364.0
COc1ccc(Oc2cccc(/C=C/c3cc(C)c4n3[B-](F)(F)[N+]3=CC=CC3=C4)c2)cc1,CS(C)=O,555.0
COc1ccc([C@@H](Nc2ccc(C)cc2)C2=C(O)C(=O)c3ccccc3C2=O)cc1,CCO,456.0
COc1ccc([C@@H]2C[C@](O)(c3ccccn3)C[C@](O)(c3ccccn3)[C@H]2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,366.0
COc1ccc([C@@H]2C[C@](O)(c3ccccn3)C[C@](O)(c3ccccn3)[C@H]2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CC#N,366.0
COc1ccc([C@@H]2C[C@](O)(c3ccccn3)C[C@](O)(c3ccccn3)[C@H]2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CCO,366.0
COc1ccc([C@@H]2C[C@](O)(c3ccccn3)C[C@](O)(c3ccccn3)[C@H]2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CCOC(C)=O,366.0
COc1ccc([C@@H]2C[C@](O)(c3ccccn3)C[C@](O)(c3ccccn3)[C@H]2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CN(C)C=O,358.0
COc1ccc([C@@H]2C[C@](O)(c3ccccn3)C[C@](O)(c3ccccn3)[C@H]2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,370.0
COc1ccc([C@@H]2C[C@](O)(c3ccccn3)C[C@](O)(c3ccccn3)[C@H]2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,c1ccccc1,370.0
COc1ccc([N+](=O)[O-])c(C2=CC3=C(c4ccccc4)c4cccn4[B-](F)(F)[N+]3=C2)c1,ClCCl,517.0
COc1ccc([N+]2=Cc3cccn3[B-]2(c2ccccc2)c2ccccc2)cc1,C1CCOC1,386.29283489096576
COc1ccc([Si](C)(C)C)c2ccccc12,C1CCCCC1,312.0
COc1ccc2[nH]c3ccsc3c2c1,CS(C)=O,250.0
COc1ccc2c(-c3ccccc3C(=O)[O-])c3c([o+]c2c1)-c1ccc(N)cc1C3,O,490.0
COc1ccc2c(-c3nc(-c4cccc(Br)c4)no3)cc(=O)oc2c1,CCO,259.0
COc1ccc2c(-c3nc(-c4cccc(Br)c4)no3)cc(=O)oc2c1,ClC(Cl)Cl,360.0
COc1ccc2c(-c3nc(-c4cccc(C)c4)no3)cc(=O)oc2c1,CCO,401.0
COc1ccc2c(-c3nc(-c4cccc(C)c4)no3)cc(=O)oc2c1,ClC(Cl)Cl,403.0
COc1ccc2c(-c3nc(-c4ccccc4Cl)no3)cc(=O)oc2c1,CCO,354.0
COc1ccc2c(-c3nc(-c4ccccc4Cl)no3)cc(=O)oc2c1,ClC(Cl)Cl,355.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,C1CCOC1,411.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CC#N,421.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CCCCO,426.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CCCO,426.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CCO,426.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CCOC(C)=O,417.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CN(C)C=O,425.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CO,428.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,CS(C)=O,426.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,Cc1ccccc1,405.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,ClC(Cl)(Cl)Cl,419.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,ClCCl,408.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,O,405.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1cc(Cl)ccc1NC3(C)C,c1ccccc1,420.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,C1CCOC1,404.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CC#N,415.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CCCCO,424.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CCCO,421.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CCO,424.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CCOC(C)=O,395.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CN(C)C=O,421.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CO,424.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,CS(C)=O,424.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,Cc1ccccc1,397.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,ClC(Cl)(Cl)Cl,404.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,ClCCl,403.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,O,383.0
COc1ccc2c(=O)c3c([nH]c2c1)-c1ccccc1NC3(C)C,c1ccccc1,402.0
COc1ccc2c(C#N)cc3ccc4cc(C#N)c5ccc(OC)cc5c4c3c2c1,ClC(Cl)Cl,422.0
COc1ccc2c(C=C(C#N)C#N)cc3ccc4cc(C=C(C#N)C#N)c5ccc(OC)cc5c4c3c2c1,ClC(Cl)Cl,456.0
COc1ccc2c(CC(=O)O)cc(=O)oc2c1,CO,323.0
COc1ccc2c(COc3ccc(Cl)cc3/C=N/N=C/c3cc(Cl)ccc3OCc3cc(=O)oc4cc(OC)ccc34)cc(=O)oc2c1,C1CCOC1,326.0
COc1ccc2c(c1)-c1cc(OC)ccc1C2=O,C1CCCCC1,361.0
COc1ccc2c(c1)-c1cc(OC)ccc1C2=O,CC#N,376.0
COc1ccc2c(c1)-c1cc(OC)ccc1C2=O,CCO,382.0
COc1ccc2c(c1)-c1cc3c(cc1[Si]2(c1ccccc1)c1ccccc1)-c1ccccc1[Si]3(c1ccccc1)c1ccccc1,ClCCl,334.0
COc1ccc2c(c1)-c1nc(-c3ccccc3)c3cc(Cl)ccc3[n+]1[B-](F)(F)O2,Cc1ccccc1,440.0
COc1ccc2c(c1)-c1oc(=O)c3c(=N)n4[nH]c(-c5ccccc5)cc4c(C#N)c3c1CC2,CN(C)C=O,428.0
COc1ccc2c(c1)C(=O)c1cc(OC)cc(OC)c1-2,C1CCCCC1,478.0
COc1ccc2c(c1)C(=O)c1cc(OC)cc(OC)c1-2,CC#N,491.0
COc1ccc2c(c1)C(=O)c1cc(OC)cc(OC)c1-2,CCO,492.0
COc1ccc2c(c1)C(=O)c1ccccc1-2,C1CCCCC1,421.0
COc1ccc2c(c1)C(=O)c1ccccc1-2,CC#N,432.0
COc1ccc2c(c1)C(=O)c1ccccc1-2,CCO,433.0
COc1ccc2c(c1)C(C)(C)C1(C=Cc3c(c(-c4nc(-c5ccccc5)c(-c5ccccc5)o4)cc4ccccc34)O1)N2C,Cc1ccccc1,309.0
COc1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,CO,462.0
COc1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,CS(C)=O,467.0
COc1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,Cc1ccccc1,467.0
COc1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,ClCCl,462.0
COc1ccc2c(c1)C(C)(C)C1=[N+]2[B-](F)(F)n2cccc2-c2c1cc1n2CC=C1,O,470.0
COc1ccc2c(c1)CCC1=C(C#Cc3ccc(Cl)cc3)O[B-](F)(F)[O+]=C12,ClCCl,445.0
COc1ccc2c(c1)CCC1=C(C#Cc3ccccc3)O[B-](F)(F)[O+]=C12,ClCCl,443.0
COc1ccc2c(c1)CCC1=C(c3ccccc3)C3=C(c4ccc5cccc(O)c5n4)c4c(-c5ccccc5)c5c(n4[B-](F)(F)[N+]3=C12)-c1ccc(OC)cc1CC5,O,660.0
COc1ccc2c(c1)CCC1=C(c3ccccc3)C3=Nc4c(-c5ccccc5)c5c(n4[B-](F)(F)[N+]3=C12)-c1ccc(OC)cc1CC5,ClC(Cl)Cl,740.0
COc1ccc2c(c1)CCc1c(-c3ccccc3)c3n(c1-2)[B-](F)(F)[N+]1=C2C(=C(c4ccccc4)C1=N3)CCc1ccccc12,ClC(Cl)Cl,723.0
COc1ccc2c(c1)CCc1c(-c3ccccc3)c3n(c1-2)[B-](F)(F)[N+]1=C2C=NC=CN2[B-](F)(F)[N+]1=C3,ClCCl,546.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,C1CCOC1,362.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,C1COCCO1,366.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,CC#N,364.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,CCCCCC,360.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,CCO,370.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,CN(C)C=O,375.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,CO,371.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,CS(C)=O,379.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,ClC(Cl)Cl,368.0
COc1ccc2c(c1)CCc1c-2nc(N)c(C#N)c1-c1ccc(Br)cc1,ClCCl,365.0
COc1ccc2c(c1)N(c1ccc(C)cc1)c1cc3c(cc1=N2)Oc1c(cc(C(C)(C)C)cc1C(C)(C)C)N=3,CC#N,540.0
COc1ccc2c(c1)N(c1ccc(C)cc1)c1cc3c(cc1=N2)Oc1c(cc(C(C)(C)C)cc1C(C)(C)C)N=3,CCCCCC,562.0
COc1ccc2c(c1)N(c1ccc(C)cc1)c1cc3c(cc1=N2)Oc1c(cc(C(C)(C)C)cc1C(C)(C)C)N=3,CO,555.0
COc1ccc2c(c1)N(c1cccc(N3C(=O)C(=C[Si](C(C)C)(C(C)C)C(C)C)Oc4ccc(OC)cc43)c1)C(=O)C(=C[Si](C(C)C)(C(C)C)C(C)C)O2,C1CCCCC1,313.0
COc1ccc2c(c1)N(c1ccccc1-c1ccccc1)c1cc3c(cc1=N2)Oc1c(cc(C(C)(C)C)cc1C(C)(C)C)N=3,CC#N,532.0
COc1ccc2c(c1)N(c1ccccc1-c1ccccc1)c1cc3c(cc1=N2)Oc1c(cc(C(C)(C)C)cc1C(C)(C)C)N=3,CCCCCC,559.0
COc1ccc2c(c1)N(c1ccccc1-c1ccccc1)c1cc3c(cc1=N2)Oc1c(cc(C(C)(C)C)cc1C(C)(C)C)N=3,CO,552.0
COc1ccc2c(c1)O[B-]13Oc4cc(OC)ccc4-c4cc(-c5ccccc5)c(n41)N=C1C(c4ccccc4)=CC2=[N+]13,ClC(Cl)Cl,764.5
COc1ccc2c(c1)SC1=Nc3sc4cc(OC)ccc4[n+]3CN12,CO,405.0
COc1ccc2c(c1)SCC1=C(c3ccccc3)C3=Nc4c(-c5ccccc5)c5c(n4[B-](F)(F)[N+]3=C12)-c1ccc(OC)cc1SC5,ClC(Cl)Cl,706.0
COc1ccc2c(c1)[n+]([O-])nc(N)[n+]2[O-],CC#N,432.0
COc1ccc2c(c1)[n+]([O-])nc(N)[n+]2[O-],O,440.0
COc1ccc2c(c1)[nH]c1c3[nH]c4cc(OC)ccc4c3c3nsnc3c21,CN(C)C=O,436.0
COc1ccc2c(c1)[nH]c1c3[nH]c4cc(OC)ccc4c3c3nsnc3c21,Cc1ccccc1,425.0
COc1ccc2c(c1)[nH]c1c3[nH]c4cc(OC)ccc4c3c3nsnc3c21,ClCCl,430.0
COc1ccc2c(c1)[nH]c1c3cccc4c3c(cc21)C(=O)N(c1c(C)cccc1C)C4=O,CC#N,409.0
COc1ccc2c(c1)[nH]c1c3cccc4c3c(cc21)C(=O)N(c1c(C)cccc1C)C4=O,CS(C)=O,419.0
COc1ccc2c(c1)[nH]c1c3cccc4c3c(cc21)C(=O)N(c1c(C)cccc1C)C4=O,Cc1ccccc1,398.0
COc1ccc2c(c1)[nH]c1c3cccc4c3c(cc21)C(=O)N(c1c(C)cccc1C)C4=O,ClCCl,409.0
COc1ccc2c(c1)c(-c1ccc(C(C)(C)C)cc1)c(-c1ccc(C(C)(C)C)cc1)[n+]1c3ccccc3c(-c3ccc(C(C)(C)C)cc3)c(-c3ccc(C(C)(C)C)cc3)c21,ClCCl,452.0
COc1ccc2c(c1)c(-c1ccc(C(F)(F)F)cc1)c(-c1ccc(C(F)(F)F)cc1)[n+]1c3ccccc3c(-c3ccc(C(F)(F)F)cc3)c(-c3ccc(C(F)(F)F)cc3)c21,ClCCl,438.0
COc1ccc2c(c1)c(-c1ccc(Cl)cc1)c(-c1ccc(Cl)cc1)[n+]1c3ccccc3c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)c21,ClCCl,445.0
COc1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3cc(Cl)ccc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,453.0
COc1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3cc4ccccc4cc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,461.0
COc1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3ccc(Cl)cc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,447.0
COc1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3ccc(F)cc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,443.0
COc1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3ccc(N4CCCCC4)cc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,548.0
COc1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3ccc(OC)cc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,452.0
COc1ccc2c(c1)c(=O)c1ccccc1n2CCCCCC(=O)O,O,422.0
COc1ccc2c(c1)c(C#N)c(C#N)c1cc(OC)ccc12,ClC(Cl)Cl,403.0
COc1ccc2c(c1)c(C#N)cc1c(OC)c(OC)c3cc(C#N)c4cc(OC)ccc4c3c12,ClC(Cl)Cl,471.0
COc1ccc2c(c1)c(C=O)c1c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)n12,CC#N,405.0
COc1ccc2c(c1)c(C=O)c1c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)n12,CS(C)=O,408.0
COc1ccc2c(c1)c(C=O)c1c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)n12,CC#N,402.0
COc1ccc2c(c1)c(C=O)c1c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)n12,CS(C)=O,407.0
COc1ccc2c(c1)c1c(-c3ccccc3)c3oc4ccccc4c3cc1n2C,CCO,336.0
COc1ccc2c(c1)c1c(OC)c3ccccc3c(OC)c1n2C,C1CCCCC1,421.0
COc1ccc2c(c1)c1c(OC)c3ccccc3c(OC)c1n2C,CC#N,422.0
COc1ccc2c(c1)c1c(OC)c3ccccc3c(OC)c1n2C,CO,421.0
COc1ccc2c(c1)c1c(OC)c3ccccc3c(OC)c1n2C,ClCCl,425.0
COc1ccc2c(c1)c1cc(OC)ccc1c1c2ccc2cccc(C(=O)NC(C)(C)C)c21,ClCCl,342.0
COc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc2c(c1)c1cc(-n3c4ccc(OC)cc4c4cc(OC)ccc43)ccc1n2-c1ccc(/C=C(\C#N)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)s2)cc1,ClCCl,465.0
COc1ccc2c(c1)c1cc(OC)ccc1n2-c1ccc2nc(/C=C(\C#N)C(=O)O)ccc2c1,ClC(Cl)Cl,452.0
COc1ccc2c(c1)c1cc(OC)ccc1n2-c1cccc(-n2c3ccc(OC)cc3c3cc(OC)ccc32)c1C#N,Cc1ccccc1,391.0
COc1ccc2c(c1)c1ccccc1n1c3ccccc3nc21,CC#N,308.0
COc1ccc2c(c1)c1ccccc1n2-c1nc2ccccc2nc1-n1c2ccccc2c2cc(OC)ccc21,Cc1ccccc1,423.0
COc1ccc2c(c1)cc(C)c1c3ccccc3[nH]c21,ClCCl,305.0
COc1ccc2c(c1)nc(-c1ccccc1)n2-c1ccccc1,CC#N,268.0
COc1ccc2c(c1)oc1c(-c3ccccc3)c3c4ccccc4n(C)c3cc12,CCO,337.0
COc1ccc2c(c1O)C(=O)OC2,CN(C)C=O,456.0
COc1ccc2c3c(OC)c4ccccc4c(OC)c3n(C)c2c1,C1CCCCC1,392.0
COc1ccc2c3c(OC)c4ccccc4c(OC)c3n(C)c2c1,CC#N,393.0
COc1ccc2c3c(OC)c4ccccc4c(OC)c3n(C)c2c1,CO,392.0
COc1ccc2c3c(OC)c4ccccc4c(OC)c3n(C)c2c1,ClCCl,396.0
COc1ccc2c3c(c(-c4nc(-c5ccccc5)c(-c5ccccc5)o4)cc2c1)OC1(C=C3)N(C)c2ccc(Cl)cc2C1(C)C,Cc1ccccc1,305.0
COc1ccc2c3c(c(-c4nc(-c5ccccc5)c(-c5ccccc5)o4)cc2c1)OC1(C=C3)N(CC(C)C)c2ccccc2C1(C)C,Cc1ccccc1,396.0
COc1ccc2c3c(c4ccc(OC)cc4c2c1)C(C)(C)c1c-3ccc2ccccc12,C1CCCCC1,391.0
COc1ccc2c3c(c4ccc(OC)cc4c2c1)C(C)(C)c1cc(-c2ccccc2)ccc1-3,C1CCCCC1,389.0
COc1ccc2c3c(c4ccc(OC)cc4c2c1)C(C)(C)c1ccc2ccccc2c1-3,C1CCCCC1,391.0
COc1ccc2c3c(c4ccc(OC)cc4c2c1)C(C)(C)c1sccc1-3,C1CCCCC1,391.0
COc1ccc2c3c(c4ccc(OC)cc4c2c1)C1(c2ccccc2-c2ccccc21)c1ccccc1-3,C1CCCCC1,386.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,C1CCCCC1,355.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,C1CCOC1,359.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,CC#N,360.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,CC(C)CC(C)(C)C,353.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,CCCCCCCCCCCC,355.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,CCO,363.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,CN(C)C=O,363.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,CO,364.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,CS(C)=O,365.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,ClC(Cl)(Cl)Cl,357.0
COc1ccc2c3c(cccc13)C(=O)N(C)C2=O,O,375.0
COc1ccc2c3ccc(C(C)(C)C)cc3n[n+](-c3cccc(C(C)(C)C)c3)c2c1,ClCCl,477.0
COc1ccc2c3ccc(OC)cc3c3cc4c(C)cc(=O)oc4cc3c2c1,ClC(Cl)Cl,365.0
COc1ccc2c3ccc(OC)cc3n(-c3ccc(-c4nnc(-c5c(C)cc(C)cc5C)o4)cc3C)c2c1,Cc1ccccc1,319.0
COc1ccc2c3cccc4c(OC)ccc(c5cccc1c52)c43,C1CCOC1,458.0
COc1ccc2c3cccc4c(OC)ccc(c5cccc1c52)c43,Cc1ccccc1,459.0
COc1ccc2c3cccc4c(OC)ccc(c5cccc1c52)c43,ClC(Cl)(Cl)Cl,460.0
COc1ccc2c3cccc4c(OC)ccc(c5cccc1c52)c43,ClC(Cl)Cl,459.0
COc1ccc2c3cccc4c(OC)ccc(c5cccc1c52)c43,ClCCl,459.0
COc1ccc2c3cccc4c(OC)ccc(c5cccc1c52)c43,c1ccncc1,463.0
COc1ccc2c3ccccc3c3nc4ccccc4n3c2c1,CC#N,359.0
COc1ccc2c3ccccc3n3c4ccccc4nc3c2c1,CC#N,337.0
COc1ccc2cc(-c3c4ccc(=[NH2+])cc-4n(C)c4c5c(ccc34)NC(C)(C)C=C5C)ccc2c1,O,505.0
COc1ccc2cc(-c3c4ccc(=[NH2+])cc-4n(C)c4cc(N(C)C)ccc34)ccc2c1,O,475.0
COc1ccc2cc(-c3c4ccc(=[NH2+])cc-4oc4cc(N(C)C)ccc34)ccc2c1,O,520.0
COc1ccc2cc(-c3c4ccc(=[NH2+])cc-4oc4cc(O)ccc34)ccc2c1,O,500.0
COc1ccc2cc(-c3c4ccc(=[NH2+])cc-4sc4cc(N)ccc34)ccc2c1,O,525.0
COc1ccc2cc(-c3cc(-c4ccccc4)c4n3[B-](F)(F)[N+]3=C5C=NC=CN5[B-](F)(F)[N+]3=C4)ccc2c1,ClCCl,536.0
COc1ccc2cc(-c3cc4ccc(OC)cc4oc3=O)oc2c1,CC#N,388.0
COc1ccc2cc(-c3cc4ccc(OC)cc4oc3=O)oc2c1,CCOC(C)=O,390.0
COc1ccc2cc(-c3cc4ccc(OC)cc4oc3=O)oc2c1,CS(C)=O,394.0
COc1ccc2cc(-c3cc4ccc(OC)cc4oc3=O)oc2c1,Cc1ccccc1,395.0
COc1ccc2cc(-c3cc4ccc(OC)cc4oc3=O)oc2c1,O,361.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCCCCC,326.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCCCCCCCO,327.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCCCO,326.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCCO,325.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCO,324.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CCOC(C)=O,326.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CN(C)C=O,328.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,CO,324.0
COc1ccc2cc(-c3ccc(C(F)(F)F)cc3)oc(=O)c2c1,ClC(Cl)Cl,327.0
COc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,C1CCOC1,342.0
COc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CCCCCC,338.0
COc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CCO,342.0
COc1ccc2cc(-c3ccc(C)cc3)c(=O)oc2c1,CS(C)=O,345.0
COc1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CCO,331.0
COc1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CCOC(C)=O,331.0
COc1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CN(C)C=O,333.0
COc1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,CO,330.0
COc1ccc2cc(-c3ccc(S(C)(=O)=O)cc3)oc(=O)c2c1,ClC(Cl)Cl,334.0
COc1ccc2cc(-c3cccc(-c4cc5ccc(OC)cc5oc4=O)c3)c(=O)oc2c1,ClC(Cl)Cl,344.0
COc1ccc2cc(-c3ccsc3)c(=O)oc2c1,ClC(Cl)Cl,372.0
COc1ccc2cc(-c3sc(C=C(C#N)c4ccc(OC)c(OC)c4)c4c3OCCO4)ccc2c1,ClCCl,365.0
COc1ccc2cc(-c3scc4c3OCCO4)ccc2c1,ClCCl,318.0
COc1ccc2cc(/C=C/C3=C4CCc5ccccc5C4=[O+][B-](F)(F)O3)ccc2c1,ClCCl,479.0
COc1ccc2cc(/C=C/C3=CC(c4ccccc4)=[O+][B-](F)(F)O3)ccc2c1,ClCCl,456.0
COc1ccc2cc(/C=C/C3=[O+][B-](F)(F)OC(/C=C/c4ccc5cc(OC)ccc5c4)=C3c3ccccc3)ccc2c1,ClCCl,526.0
COc1ccc2cc(/C=C/c3ccc([N+](=O)[O-])cc3)c(=O)oc2c1,CC#N,392.0
COc1ccc2cc(/C=C/c3ccc4ccccc4[nH+]3)ccc2c1,ClC(Cl)Cl,428.0
COc1ccc2cc(/C=C/c3ccc4ccccc4n3)ccc2c1,ClC(Cl)Cl,354.0
COc1ccc2cc(/C=C/c3ccc4ccccc4n3)ccc2c1,ClCCl,354.0
COc1ccc2cc(/C=C/c3ccnc4ccccc34)ccc2c1,ClC(Cl)Cl,354.0
COc1ccc2cc(/C=C/c3ccnc4ccccc34)ccc2c1,ClCCl,354.0
COc1ccc2cc(/C=C/c3nc(/C=C/c4ccc(N(C)C)cc4)cc(/C=C/c4ccc(N(C)C)cc4)n3)ccc2c1,ClCCl,418.0
COc1ccc2cc(/C=C/c3nc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)n3)ccc2c1,ClCCl,424.0
COc1ccc2cc(C#Cc3ccc([N+](=O)[O-])cc3)ccc2c1,C1CCOC1,356.0
COc1ccc2cc(C#Cc3ccc([N+](=O)[O-])cc3)ccc2c1,ClC(Cl)Cl,360.0
COc1ccc2cc(C#Cc3ccc([N+](=O)[O-])cc3)ccc2c1,ClCCl,356.0
COc1ccc2cc(C#N)c(=N)oc2c1,ClCCl,358.0
COc1ccc2cc(C(=O)ON3C(=O)C=CC3=O)c(=O)oc2c1,CO,358.0
COc1ccc2cc(C3=[N+]4C(=Nc5c(-c6ccc7ccccc7c6)c(Br)c(-c6ccc7cc(OC)ccc7c6)n5[B-]4(F)F)C(c4ccc5ccccc5c4)=C3Br)ccc2c1,ClCCl,698.0
COc1ccc2cc(C3=[N+]4C(=Nc5c(-c6ccc7ccccc7c6)cc(-c6ccc7cc(OC)ccc7c6)n5[B-]4(F)F)C(c4ccc5ccccc5c4)=C3)ccc2c1,ClCCl,718.0
COc1ccc2cc([C@H](C)C(=O)O)ccc2c1,CC#N,332.4
COc1ccc2cc([C@H](C)C(=O)O)ccc2c1,CCCCO,333.3
COc1ccc2cc([C@H](C)C(=O)O)ccc2c1,CCO,332.2
COc1ccc2cc([C@H](C)C(=O)O)ccc2c1,CO,332.4
COc1ccc2cc([C@H](C)C(=O)O)ccc2c1,ClCCl,333.6
COc1ccc2cc([C@H](C)C(=O)O)ccc2c1,O,331.2
COc1ccc2cc3cccc[n+]3cc2c1,O,406.0
COc1ccc2ccc(O)cc2c1,O,325.0
COc1ccc2ccc([O-])cc2c1,O,337.0
COc1ccc2ccc3oc(=O)c(-c4ccccc4)nc3c2c1,c1ccccc1,404.0
COc1ccc2ccccc2c1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,575.0
COc1ccc2ccccc2c1C1=CC(c2ccccc2)=C(c2ccccc2)C1,ClCCl,340.0
COc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CC#N,474.0
COc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CCCCCC,517.0
COc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CCOC(C)=O,506.0
COc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,CO,480.0
COc1ccc2n1[B-](F)(F)[N+]1=C(SC#N)C=CC1=C2c1ccccc1,ClCCl,508.0
COc1ccc2n1[B-](F)(F)[N+]1=C(c3ccccc3)C=CC1=C2c1ccc(C)cc1,C1CCCCC1,532.0
COc1ccc2n1[B-](F)(F)[N+]1=C(c3ccccc3)C=CC1=C2c1ccc(C)cc1,C1CCOC1,528.0
COc1ccc2n1[B-](F)(F)[N+]1=C(c3ccccc3)C=CC1=C2c1ccc(C)cc1,C1COCCO1,529.0
COc1ccc2n1[B-](F)(F)[N+]1=C(c3ccccc3)C=CC1=C2c1ccc(C)cc1,CCOC(C)=O,526.0
COc1ccc2n1[B-](F)(F)[N+]1=C(c3ccccc3)C=CC1=C2c1ccc(C)cc1,CO,523.0
COc1ccc2n1[B-](F)(F)[N+]1=C(c3ccccc3)C=CC1=C2c1ccc(C)cc1,Cc1ccccc1,534.0
COc1ccc2n1[B-](F)(F)[N+]1=C(c3ccccc3)C=CC1=C2c1ccc(C)cc1,ClC(Cl)Cl,530.0
COc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CC#N,493.0
COc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CCCCCC,499.0
COc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CCOC(C)=O,495.0
COc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,CO,495.0
COc1ccc2n1[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,ClCCl,499.0
COc1ccc2nc(/N=N/c3ccc(N(C)C)cc3)sc2c1,CC#N,506.0
COc1ccc2nc(/N=N/c3ccc(N(C)C)cc3)sc2c1,ClCCl,506.0
COc1ccc2nc(N)n[n+]([O-])c2c1,CC#N,430.0
COc1ccc2nc(N)n[n+]([O-])c2c1,O,441.0
COc1ccc2nc(N)sc2c1,CC#N,305.0
COc1ccc2nc(N)sc2c1,ClCCl,305.0
COc1ccc2nc(N=Nc3c(-c4ccccc4)[nH]c4ccccc34)sc2c1,ClC(Cl)Cl,543.0
COc1ccc2nc(N=Nc3c(-c4ccccc4)n(C)c4ccccc34)sc2c1,ClC(Cl)Cl,536.0
COc1ccc2nc(N=Nc3c(C)n(C)c4ccccc34)sc2c1,ClC(Cl)Cl,519.0
COc1ccc2nc3[nH]c(=O)c(C#N)cc3cc2c1,CC(C)=O,398.0
COc1ccc2nc3c(cnc4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)cc43)cc2c1,ClCCl,369.0
COc1ccc2nc3nc(-c4ccc(Cl)cc4)ccc3cc2c1,CC(C)=O,403.0
COc1ccc2nc3nc(C)c(C(C)=O)cc3cc2c1,CC(C)=O,375.0
COc1ccc2nc3nc(C)ccc3cc2c1,CC(C)=O,371.0
COc1ccc2nc3nc4c(cc3cc2c1)-c1cc(OC)c(OC)cc1C4,CC(C)=O,398.0
COc1ccc2nc3nc4c(cc3cc2c1)-c1ccccc1C4,CC(C)=O,373.0
COc1ccc2nc3nc4c(cc3cc2c1)C(=O)CC(C)(C)C4,CN(C)C=O,407.0
COc1ccc2ncccc2c1,CC#N,329.0
COc1ccc2ncccc2c1,CCCC#N,329.0
COc1ccc2ncccc2c1,Cc1ccccc1,331.0
COc1ccc2nn(C)c(-c3ccc(C)o3)c2c1,CC#N,340.0
COc1ccc2nn(C)c(-c3ccc(C)o3)c2c1,ClCCl,343.0
COc1ccc2nn(C)c(-c3ccc(C)s3)c2c1,CC#N,332.0
COc1ccc2nn(C)c(-c3ccc(C)s3)c2c1,ClCCl,334.0
COc1ccc2nn(C)c(-c3ccc(C=O)o3)c2c1,CC#N,371.0
COc1ccc2nn(C)c(-c3ccc(C=O)o3)c2c1,ClCCl,377.0
COc1ccc2nn(C)c(-c3ccc(C=O)s3)c2c1,CC#N,381.0
COc1ccc2nn(C)c(-c3ccc(C=O)s3)c2c1,ClCCl,388.0
COc1ccc2nn(C)c(-c3ccc(OC)o3)c2c1,CC#N,346.0
COc1ccc2nn(C)c(-c3ccc(OC)o3)c2c1,ClCCl,348.0
COc1ccc2oc(-c3cc4cc(OC)ccc4oc3=O)cc2c1,CC#N,382.0
COc1ccc2oc(-c3cc4cc(OC)ccc4oc3=O)cc2c1,CCOC(C)=O,384.0
COc1ccc2oc(-c3cc4cc(OC)ccc4oc3=O)cc2c1,CS(C)=O,389.0
COc1ccc2oc(-c3cc4cc(OC)ccc4oc3=O)cc2c1,Cc1ccccc1,388.0
COc1ccc2oc(-c3cc4cc(OC)ccc4oc3=O)cc2c1,O,347.0
COc1ccc2occ(-c3ccccc3)c(=O)c2c1,O,288.0
COc1cccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,CC#N,393.0
COc1cccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,CO,395.0
COc1cccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,ClCCl,396.0
COc1cccc(-c2c3c(n4ccc(C(C)=O)cc24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)c1,ClCCl,405.0
COc1cccc(-c2c3ccc(=[NH2+])cc-3n(C)c3c4c(ccc23)NC(C)(C)C=C4C)c1,O,500.0
COc1cccc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)c1,O,490.0
COc1cccc(-c2c3ccc(=[NH2+])cc-3oc3c4c(ccc23)NC(C)(C)C=C4C)c1,O,540.0
COc1cccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(C)C)ccc23)c1,O,530.0
COc1cccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N)ccc23)c1,O,500.0
COc1cccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)c1,O,535.0
COc1cccc(-c2c3ccc(=[NH2+])cc-3oc3cc(O)ccc23)c1,O,500.0
COc1cccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]2=C3)c1,CC#N,552.0
COc1cccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]2=C3)c1,CCCCCC,564.0
COc1cccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]2=C3)c1,CN(C)C=O,561.0
COc1cccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]2=C3)c1,Cc1ccccc1,571.0
COc1cccc(-c2c3ccccc3c3n2[B-](F)(F)[N+]2=Cc4c5ccccc5c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]2=C3)c1,ClCCl,563.0
COc1cccc(-c2ccc(-c3cccc(OC)c3)c3[nH]c(-c4ccc(C=C(C#N)C(=O)O)cc4)nc23)c1,ClC(Cl)Cl,360.0
COc1cccc(-c2coc3cc(O)ccc3c2=O)c1,O,337.0
COc1cccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c1,CO,300.0
COc1cccc(-c2nc3c([nH]2)C2=CC(=O)S[C@]2(C)[C@@]2(C)SC(=O)C=C32)c1OC,CC#N,397.0
COc1cccc(-c2nc3c(cc2-c2ccc4ccccc4c2)c(-c2ccc(C)cc2)c(-c2ccc(F)cc2)n3C)c1,C1CCOC1,331.0
COc1cccc(-c2nc3sc4ccccc4c3s2)c1,CS(C)=O,350.0
COc1cccc(-c2oc3cccc4[n+]3c2-c2ccccc2-4)c1,ClCCl,376.0
COc1cccc(-n2c(-c3ccc(F)cc3)nc(C)c2C)c1,CCCCCC,284.0
COc1cccc(-n2c(-c3ccc(F)cc3)nc(C)c2C)c1,CCCCO,289.0
COc1cccc(-n2c(-c3ccc(F)cc3)nc(C)c2C)c1,CCO,290.0
COc1cccc(-n2c(-c3ccc(F)cc3)nc(C)c2C)c1,CCOC(C)=O,288.0
COc1cccc(-n2c(-c3ccc(F)cc3)nc(C)c2C)c1,ClCCl,284.0
COc1cccc(-n2c(-c3ccc(O)cc3)nc(C)c2C)c1,CC#N,288.0
COc1cccc(-n2c(-c3ccc(O)cc3)nc(C)c2C)c1,CCO,292.0
COc1cccc(-n2c(-c3ccc(O)cc3)nc(C)c2C)c1,CO,287.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,C1COCCO1,287.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,CC#N,288.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,CCCCO,290.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,CCO,292.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,CCOC(C)=O,290.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,CO,289.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,ClCCl,282.0
COc1cccc(-n2c(-c3ccccc3)nc(C)c2C)c1,c1ccccc1,284.0
COc1cccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)c1,CC#N,373.0
COc1cccc(/C=C/C(=O)c2c(O)cc(C)oc2=O)c1,ClCCl,377.0
COc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1F,CS(C)=O,554.0
COc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1O,CS(C)=O,561.0
COc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1OC,CS(C)=O,556.0
COc1cccc(/C=C/c2ccc3n2[B-](F)(F)[N+]2=C(C)C=C(C)C2=C3)c1,CO,560.0
COc1cccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)c1,C1CCCCC1,591.0
COc1cccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)c1,C1CCOC1,587.0
COc1cccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)c1,CC#N,569.0
COc1cccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)c1,Cc1ccccc1,593.0
COc1cccc(C2=C(c3ccc(C(C)(C)C)cc3)C(c3ccc(C(C)(C)C)cc3)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c(-c4ccc(C(C)(C)C)cc4)c(-c4ccc(C(C)(C)C)cc4)n2[B-]3(F)F)c1,ClCCl,583.0
COc1cccc(C2=C(c3cccc(OC)c3)c3cc(C(C)(C)C)cc4c(-c5cccc(OC)c5)c(-c5cccc(OC)c5)nc(c34)O2)c1,ClCCl,390.0
COc1cccc(C2=C3C=C(/C=C/C(=O)OC(C)(C)C)C=[N+]3[B-](F)(F)n3cccc32)c1,ClCCl,539.0
COc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(OC)c5)c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]3=C2c2cccc(OC)c2)c1,C1CCCCC1,596.0
COc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(OC)c5)c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]3=C2c2cccc(OC)c2)c1,C1CCOC1,592.0
COc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(OC)c5)c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]3=C2c2cccc(OC)c2)c1,CC#N,581.0
COc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(OC)c5)c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]3=C2c2cccc(OC)c2)c1,Cc1ccccc1,596.0
COc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(OC)c5)c(-c5cccc(OC)c5)n4[B-](F)(F)[N+]3=C2c2cccc(OC)c2)c1,ClCCl,588.0
COc1cccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)c1,C1CCCCC1,680.0
COc1cccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)c1,C1CCOC1,677.0
COc1cccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)c1,CC#N,670.0
COc1cccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)c1,Cc1ccccc1,682.0
COc1cccc(C2=c3c(c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc34)=[N+]3C2=C(c2ccccc2)c2c(-c4cccc(OC)c4)c4c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc5c4n2[B-]3(F)F)c1,ClCCl,677.0
COc1cccc(C=CC2=CC3=C4C=C(C=Cc5cccc(OC)c5)C=CN4[Ru]4(N=C=S)(N=C=S)(N3C=C2)N2C=CC(C(=O)O)=CC2=C2C=C(C(=O)O)C=CN24)c1,CC#N,543.0
COc1cccc(C=NNC(=O)c2cc3ccccc3cc2O)c1O,CO,225.0
COc1cccc(F)c1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,558.0
COc1cccc(N=Nc2c(N)n3c(nc4ccccc43)[nH]c2=O)c1,ClC(Cl)Cl,418.0
COc1cccc(OC)c1-c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,ClCCl,534.0
COc1cccc(OC)c1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,C1CCOC1,506.0
COc1cccc(OC)c1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC#N,500.0
COc1cccc(OC)c1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC(=O)C(C)(C)C,505.0
COc1cccc(OC)c1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC(C)=O,503.0
COc1cccc(OC)c1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CCCCCC,507.0
COc1cccc(OC)c1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CCOC(C)=O,504.0
COc1cccc(OC)c1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CO,503.0
COc1cccc(OC)c1C1=C2C=CC(=[N+](C)C)C=C2P(=O)(C(C)(C)C)c2cc(N(C)C)ccc21,O,697.0
COc1cccc(OC)c1C1=C2C=CC(=[N+](C)C)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,703.0
COc1cccc(OC)c1C1=C2C=CC(=[N+](C)C)C=C2S(=O)(=O)c2cc(N(C)C)ccc21,O,710.0
COc1cccc(OC)c1C1=C2C=CC(=[N+]3CCCC3)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,706.0
COc1cccc(OC)c1C1=CC2=C(c3ccccc3)c3cc(-c4c(F)c(F)c(F)c(F)c4F)cn3[B-](F)(F)[N+]2=C1,ClCCl,553.0
COc1cccc(OC)c1C1=CC2=C(c3ccccc3)c3cc(-c4c(OC)cccc4OC)cn3[B-](F)(F)[N+]2=C1,ClCCl,580.0
COc1cccc(OC)c1C1=CC2=C(c3ccccc3)c3cccn3[B-](F)(F)[N+]2=C1,ClCCl,534.0
COc1cccc(Oc2ccccc2/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1,CS(C)=O,557.0
COc1cccc2c(-c3ccccc3)c(-c3ccccc3)[n+](-c3ccccc3)cc12,ClCCl,400.0
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CCC(O)(C(C)=O)C3OC1CC(N2CCC(OC)CC2)C(O)C(C)O1,C1COCCO1,423.0
COc1cccc2c1oc(=O)c1c(=O)oc3cc(O)ccc3c12,CS(C)=O,378.0
COc1cccc2c1oc(=O)c1c(=O)oc3cc(O)ccc3c12,ClCCl,365.0
COc1cccc2cc(-c3cc4cccc(OC)c4oc3=O)oc12,CC#N,352.0
COc1cccc2cc(-c3cc4cccc(OC)c4oc3=O)oc12,CCOC(C)=O,351.0
COc1cccc2cc(-c3cc4cccc(OC)c4oc3=O)oc12,CS(C)=O,359.0
COc1cccc2cc(-c3cc4cccc(OC)c4oc3=O)oc12,Cc1ccccc1,358.0
COc1cccc2cc(-c3cc4cccc(OC)c4oc3=O)oc12,O,363.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=N)oc12,C1CCOC1,339.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=N)oc12,CC#N,332.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=N)oc12,CS(C)=O,335.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=N)oc12,ClC(Cl)Cl,332.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=O)oc12,C1CCOC1,331.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=O)oc12,CC#N,327.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=O)oc12,CS(C)=O,334.0
COc1cccc2cc(-c3ccc([N+](=O)[O-])cc3)c(=O)oc12,ClC(Cl)Cl,329.0
COc1cccc2cc(C#N)c(=N)oc12,ClCCl,364.0
COc1cccc2cc(C)c3c4ccccc4[nH]c3c12,ClCCl,360.0
COc1cccc2cc(C)c3c4ccccc4n(C)c3c12,ClCCl,370.0
COc1cccc2oc(-c3cc4c(OC)cccc4oc3=O)cc12,CC#N,383.0
COc1cccc2oc(-c3cc4c(OC)cccc4oc3=O)cc12,CCOC(C)=O,385.0
COc1cccc2oc(-c3cc4c(OC)cccc4oc3=O)cc12,CS(C)=O,389.0
COc1cccc2oc(-c3cc4c(OC)cccc4oc3=O)cc12,Cc1ccccc1,389.0
COc1cccc2oc(-c3cc4c(OC)cccc4oc3=O)cc12,O,384.0
COc1ccccc1,C1CCCCC1,267.2367718
COc1ccccc1,CC#N,422.0
COc1ccccc1-c1c2c([o+]c3c1CCCc1cc(N)ccc1-3)-c1ccc(N)cc1CCC2,CCO,597.0
COc1ccccc1-c1c2c([o+]c3c1Cc1cc(N)ccc1-3)-c1ccc(N)cc1C2,CCO,595.0
COc1ccccc1-c1c2c(n3ccc(C#N)cc13)C(=O)N(C(C)CO)C2,ClCCl,391.0
COc1ccccc1-c1c2c(n3ccc(C(C)=O)cc13)C(=O)N(C(C)CO)C2,ClCCl,404.0
COc1ccccc1-c1c2c(n3ccccc13)C(=O)N(C(C)CO)C2,ClCCl,320.0
COc1ccccc1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,CCO,564.0
COc1ccccc1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,ClCCl,566.0
COc1ccccc1-c1ccc(-c2oc3c(C)c4c(-c5ccc(-c6ccccc6OC)cc5)c(-c5ccc(-c6ccccc6OC)cc5)oc4c(C)c3c2-c2ccc(-c3ccccc3OC)cc2)cc1,ClCCl,252.0
COc1ccccc1-c1coc2cc(O)ccc2c1=O,O,335.0
COc1ccccc1-c1nc(-c2ccc(C(F)(F)F)cc2)n(-c2ccc(C)cc2)c1-c1ccccc1OC,CC(C)O,285.0
COc1ccccc1-c1nc(-c2ccc(C(F)(F)F)cc2)n(-c2ccc(C)cc2)c1-c1ccccc1OC,CCCCCC,285.0
COc1ccccc1-c1nc(-c2ccc(C(F)(F)F)cc2)n(-c2ccc(C)cc2)c1-c1ccccc1OC,CO,284.0
COc1ccccc1-c1nc(-c2ccc(C(F)(F)F)cc2)n(-c2ccc(C)cc2)c1-c1ccccc1OC,CS(C)=O,286.0
COc1ccccc1-c1nc(-c2ccc(C(F)(F)F)cc2)n(-c2ccc(C)cc2)c1-c1ccccc1OC,ClCCl,286.0
COc1ccccc1-c1nc(-c2ccccc2)c(-c2ccccc2)[nH]1,CO,307.0
COc1ccccc1-c1nc(-c2ccccc2)c2ccccn12,C1CCCCC1,303.0
COc1ccccc1-c1nc(-c2ccccc2)c2ccccn12,CC#N,374.0
COc1ccccc1-c1nc(-c2ccccc2)c2ccccn12,CO,298.0
COc1ccccc1-c1nc(-c2ccccc2)c2ccccn12,Cl,481.0
COc1ccccc1-c1nc(-c2ccccc2)c2ccccn12,ClCCl,374.0
COc1ccccc1-c1nc(-c2ccccc2)c2ccccn12,O,330.0
COc1ccccc1-c1nc2c3ccccc3c3ccccc3c2n1-c1ccc(C)cc1,Cc1ccccc1,359.0
COc1ccccc1-c1nc2c3ccccc3c3ccccc3c2o1,Cc1ccccc1,364.0
COc1ccccc1-c1nc2c3cccnc3c3ncccc3c2n1-c1ccccc1,Cc1ccccc1,363.0
COc1ccccc1-c1nnc2ccccn12,ClCCl,285.0
COc1ccccc1-n1nc(C#N)c(N2CCCC2)n1,CC#N,318.0
COc1ccccc1/C=C/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,560.0
COc1ccccc1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,561.0
COc1ccccc1/C=c1\o/c(=C\c2ccc(N(C)C)cc2)c2ccccc12,ClCCl,406.0
COc1ccccc1/C=c1\o/c(=C\c2ccccc2)c2ccccc12,ClCCl,376.0
COc1ccccc1C#Cc1ccccc1OC,ClCCl,330.0
COc1ccccc1C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,430.0
COc1ccccc1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,C1CCOC1,503.0
COc1ccccc1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC#N,499.0
COc1ccccc1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC(=O)C(C)(C)C,502.0
COc1ccccc1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CC(C)=O,501.0
COc1ccccc1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CCCCCC,504.0
COc1ccccc1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CCOC(C)=O,502.0
COc1ccccc1C1=C2C(C)=CC(C)=[N+]2[B-](F)(F)n2c(C)cc(C)c21,CO,500.0
COc1ccccc1C1=C2C=CC(=[N+](C)C)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,701.0
COc1ccccc1C1=NC2c3cccc4cccc(c34)C2N1c1ccccc1,Cc1ccccc1,312.0
COc1ccccc1C1=[N+]2C(=C(c3ccc(I)cc3)c3ccc(-c4ccccc4OC)n3[B-]2(F)F)C=C1,ClC(Cl)Cl,547.5
COc1ccccc1C1=[N+]2C(=C(c3ccccc3)c3c4c(c(-c5ccccc5OC)n3[B-]2(F)F)C2C=CC4CC2)C2=C1C1C=CC2CC1,ClCCl,556.0
COc1ccccc1C1=[N+]2C(=Cc3c4c(c(-c5ccccc5OC)n3[B-]2(F)F)C2CCC4CC2)C2=C1C1CCC2CC1,ClCCl,550.0
COc1ccccc1C1=[N+]2C(=Cc3c4cc5ccccc5cc4c(-c4ccccc4OC)n3[B-]2(F)F)c2cc3ccccc3cc21,C1CCOC1,738.0
COc1ccccc1C1=[N+]2C(=Nc3c(-c4ccccc4)cc(-c4ccccc4OC)n3[B-]2(F)F)C(c2ccccc2)=C1,Cc1ccccc1,640.0
COc1ccccc1C1=c2cc3cc4c5c(c3cc2C2(c3ccccc3Oc3ccccc32)c2cc3c6c7c(cc3cc21)CCCN7CCC6)CCC[N+]=5CCC4,ClCCl,880.0
COc1ccccc1C=CC=NN=Cc1ccc([N+](=O)[O-])cc1,C1COCCO1,360.0
COc1ccccc1C=NCCN=Cc1ccccc1OC,ClCCl,246.0
COc1ccccc1CC(=O)OCc1c(C)c(=O)n2c(=O)c(C)c(C)n12,CCO,377.0
COc1ccccc1N=Nc1c(N)n2c(nc3ccccc32)[nH]c1=O,ClC(Cl)Cl,422.0
COc1ccccc1N=Nc1nc2ccccc2s1,CO,382.0
COc1ccccc1OCc1nnc(-c2cc(-c3ccc(Cl)cc3)nn2Cc2ccc(C(C)(C)C)cc2)o1,ClCCl,262.0
COc1ccn2c3c(c(-c4ccc(C)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,337.0
COc1ccn2c3c(c(-c4ccccc4)c2c1)CN(C(C)CO)C3=O,ClCCl,320.0
COc1ccn2c3c(c(-c4cccs4)c2c1)CN(C(C)CO)C3=O,ClCCl,335.0
COc1ccsc1-c1ccc(-c2ccc(-c3sccc3OC)s2)s1,CCCCCCCCCCCCCC,409.0
COc1cn2cc(-c3ccc(C#N)cc3)[n-][n+]2c1,ClCCl,378.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,C1CCOC1,362.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,C1COCCO1,360.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,CC#N,363.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,CCCCCCC,348.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,CCCCCCCCO,373.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,CS(C)=O,375.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,Cc1ccccc1,361.0
COc1coc2cc(-c3ccc(N(C)C)cc3)ccc2c1=O,ClCCl,368.0
COc1nc(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)s2)sc1-c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,C1CCOC1,490.0
COc1nc(-c2ccc(C=C(C#N)C(=O)O)s2)sc1-c1ccc(N(c2ccc(C)cc2)c2ccc(C)cc2)cc1,C1CCOC1,503.0
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,CC#N,407.000407
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,CC(C)=O,410.0041
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,CC(C)O,417.0141785
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,CCOC(C)=O,411.0152076
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,CO,414.9377593
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,Cc1ccccc1,419.9916002
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,Clc1ccccc1,418.0602007
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,N#Cc1ccccc1,415.9733777
COc1nc(Cl)nc(Nc2ccc3c4c(cccc24)C(=O)c2ccccc2-3)n1,O=C1CCCCC1,414.9377593
COc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,C1COCCO1,443.0
COc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CC#N,444.0
COc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CCCCOCCCC,443.0
COc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CCOC(C)=O,442.0
COc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,C1COCCO1,396.0
COc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CC#N,397.0
COc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CCCCOCCCC,396.0
COc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CCOC(C)=O,398.0
COc1nc(Nc2cc3ccc4cccc5ccc(c2)c3c45)nc(OC)n1,CC#N,336.0
COc1nc(Nc2cc3ccc4cccc5ccc(c2)c3c45)nc(OC)n1,CCCCOCCCC,336.0
COc1nc(Nc2cc3ccc4cccc5ccc(c2)c3c45)nc(OC)n1,CO,334.0
COc1nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)nc(OC)n1,C1COCCO1,443.0
COc1nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)nc(OC)n1,CC#N,444.0
COc1nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)nc(OC)n1,CCCCOCCCC,442.0
COc1nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)nc(OC)n1,CCOC(C)=O,441.0
COc1nc(Nc2ccc3cc4ccccc4cc3c2)nc(OC)n1,C1COCCO1,396.0
COc1nc(Nc2ccc3cc4ccccc4cc3c2)nc(OC)n1,CC#N,395.0
COc1nc(Nc2ccc3cc4ccccc4cc3c2)nc(OC)n1,CCCCOCCCC,398.0
COc1nc(Nc2ccc3cc4ccccc4cc3c2)nc(OC)n1,CCOC(C)=O,395.0
COc1nc(Nc2ccc3ccc4cccc5ccc2c3c45)nc(OC)n1,CC#N,340.0
COc1nc(Nc2ccc3ccc4cccc5ccc2c3c45)nc(OC)n1,CCCCOCCCC,341.0
COc1nc(Nc2ccc3ccc4cccc5ccc2c3c45)nc(OC)n1,CO,340.0
COc1nnc(Cl)nn1,ClCCl,520.0
COc1nnc(Cl)nn1,OCC(F)(F)F,518.0
CS(=O)(=O)Nc1cccc(-c2c3nc(c(-c4cccc(NS(C)(=O)=O)c4)c4ccc([nH]4)c(-c4cccc(NS(C)(=O)=O)c4)c4nc(c(-c5cccc(NS(C)(=O)=O)c5)c5ccc2[nH]5)C=C4)C=C3)c1,CN(C)C=O,647.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,CC(C)=O,358.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,CCCCCCCCO,366.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,CCCCO,366.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,CCCO,366.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,CCOC(C)=O,356.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,CN(C)C=O,367.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,CO,358.0
CS(=O)(=O)c1ccc(-c2cc3ccc(N)cc3c(=O)o2)cc1,ClC(Cl)Cl,351.0
CS(C)=O,C1COCCO1,476.0
CS1(C)C(/C=C/C2=C(c3ccc(C(=O)O)cc3)/C(=C/C=C3/N(CCCCS(=O)(=O)[O-])c4ccccc4S3(C)C)CCC2)=[N+](CCCCS(=O)(=O)[O-])c2ccccc21,CO,800.0
CSC1=C(C)C2=C(c3ccc(C)cc3)c3c(C)c(Cl)c(C)n3[B-](F)(F)[N+]2=C1C,C1CCOC1,518.0
CSC1=C(SC)SC(=Cc2ccc(N(c3ccc(/C=C(/C#N)C(=O)O)cc3)c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2)S1,CO,433.0
CSC1=C(SC)SC(=Cc2ccc(N(c3ccc(/C=C(\C#N)C(=O)O)cc3)c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)S1,CO,433.0
CSC1=C(SC)SC(=Cc2ccc(N(c3ccc(C=C4SC(SC)=C(SC)S4)cc3)c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)S1,CO,443.0
CSC1=C(SC)SC(=Cc2ccc(N(c3ccccc3)c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2)S1,CO,413.0
CSC1=CNN(N=Nc2ccc(O)c3ncccc23)S1,CS(C)=O,560.0
CSC[C@H]1O[C@@H](n2ccc3c(N)ncnc32)[C@H](O)[C@@H]1O,CC(C)=O,450.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,C1CCOC1,532.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,CC#N,537.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,CC(C)=O,536.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,CCOC(C)=O,527.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,CN(C)C=O,545.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,CO,537.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,CS(C)=O,549.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,Cc1ccccc1,527.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,ClC(Cl)Cl,538.0
CSc1cc(-c2cc3cc4c5c(c3oc2=O)CCCN5CCC4)oc(=O)c1C#N,ClCCl,541.0
CSc1ccc(-c2c3ccc(=[NH2+])cc-3n(C)c3c4c(ccc23)NC(C)(C)C=C4C)cc1,O,500.0
CSc1ccc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)cc1,O,485.0
CSc1ccc(-c2c3ccc(=[NH2+])cc-3oc3c4c(ccc23)NC(C)(C)C=C4C)cc1,O,535.0
CSc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N)ccc23)cc1,O,505.0
CSc1ccc(-c2cc(-c3ccc(SC)cc3)c3ccc4c(-c5ccc(SC)cc5)cc(-c5ccc(SC)cc5)c5ccc2c3c54)cc1,C1CCCCC1,403.0
CSc1ccc(-c2ccc(C3=C4C(=O)N(C(=O)OC(C)(C)C)C(c5ccc(-c6ccc(SC)cc6)cc5)=C4C(=O)N3C(=O)OC(C)(C)C)cc2)cc1,ClCCl,469.0
CSc1ccc(-c2ccc(C3=C4C(=O)NC(c5ccc(-c6ccc(SC)cc6)cc5)=C4C(=O)N3)cc2)cc1,ClCCl,544.0
CSc1ccc(-c2nc3sc4ccccc4c3s2)cc1,CS(C)=O,365.0
CSc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,565.0
CSc1ccc(/C=C/c2cnc3ccccc3n2)cc1,C1CCOC1,376.0
CSc1ccc(/C=C/c2cnc3ccccc3n2)cc1,CC#N,377.0
CSc1ccc(/C=C/c2cnc3ccccc3n2)cc1,CCCCCCC,373.0
CSc1ccc(/C=C/c2cnc3ccccc3n2)cc1,CS(C)=O,383.0
CSc1ccc(/C=C/c2cnc3ccccc3n2)cc1,ClCCl,381.0
CSc1ccc(/C=c2\o/c(=C\c3ccccc3)c3ccccc23)cc1,ClCCl,386.0
CSc1ccc(C#Cc2cc(C#N)c(C#Cc3cc(C#N)ccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,410.0
CSc1ccc(C#Cc2cc(C#N)c(C#Cc3ccccc3)cc2C#N)cc1,ClC(Cl)Cl,410.0
CSc1ccc(C#Cc2cc(C#N)c(C#Cc3ccccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,402.0
CSc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,ClC(Cl)Cl,375.0
CSc1ccc(C#Cc2ccc(C#Cc3ccccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,366.0
CSc1ccc(C=Cc2ccc3c(c2)c2ccccc2n3C)cc1,C1CCCCC1,337.0
CSc1ccc(C=Cc2ccn3cc(-c4ccccc4)nc3c2)cc1,O=C(O)C(F)(F)F,488.0
CSc1ccc(N=Nc2nc3ccc([N+](=O)[O-])cc3s2)cc1,CO,437.0
CSc1ccc(N=Nc2nc3ccccc3s2)cc1,CO,403.0
CSc1ccc2c(c1)N(CCCN(C)C)c1ccccc1S2,CC#N,315.0
CSc1ccc2c(c1)N(CCCN(C)C)c1ccccc1S2,CO,314.0
CSc1ccc2c(c1)N(CCCN(C)C)c1ccccc1S2,O,312.0
CSc1ccc2c(c1)N(CCCN1CCN(C)CN1C)c1ccccc1S2,CC#N,316.0
CSc1ccc2c(c1)N(CCCN1CCN(C)CN1C)c1ccccc1S2,CO,314.0
CSc1ccc2c(c1)N(CCCN1CCN(C)CN1C)c1ccccc1S2,O,312.0
CSc1cccc(-n2cc3ccccc3c/c2=N/S(=O)(=O)c2ccc(C)cc2)c1,CC#N,434.0
CSc1ccccc1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,559.0
CSc1ccccc1N=Nc1nc2ccc([N+](=O)[O-])cc2s1,CO,466.0
CSc1ccccc1N=Nc1nc2ccccc2s1,CO,428.0
CSc1cn(N=Nc2ccc(O)c3ncccc23)nn1,CO,484.0
CSc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,C1CCOC1,363.0
CSc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,CN(C)C=O,364.0
CSc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,ClC(Cl)Cl,364.0
CSc1nnc(N=Nc2c(-c3ccccc3)[nH]c3ccccc23)s1,CS(C)=O,509.0
CSc1nnc(N=Nc2c(-c3ccccc3)n(C)c3ccccc23)s1,CS(C)=O,466.0
CSc1nnc(N=Nc2c(C)n(C)c3ccccc23)s1,CS(C)=O,460.0
CSc1sc(C(C)=O)c2nn[nH]c(=O)c12,C1CCOC1,392.5
CSc1sc(C(C)=O)c2nn[nH]c(=O)c12,CC#N,393.0
CSc1sc(C(C)=O)c2nn[nH]c(=O)c12,CCO,397.0
CSc1sc(C(C)=O)c2nn[nH]c(=O)c12,CN(C)C=O,404.0
CSc1sc(C(C)=O)c2nn[nH]c(=O)c12,CO,396.0
CSc1sc(C(C)=O)c2nn[nH]c(=O)c12,CS(C)=O,400.5
CSc1sc(C(N)=O)c2nnn(C)c(=O)c12,C1CCOC1,393.0
CSc1sc(C(N)=O)c2nnn(C)c(=O)c12,CC#N,394.5
CSc1sc(C(N)=O)c2nnn(C)c(=O)c12,CCO,397.0
CSc1sc(C(N)=O)c2nnn(C)c(=O)c12,CN(C)C=O,396.5
CSc1sc(C(N)=O)c2nnn(C)c(=O)c12,CO,397.0
CSc1sc(C(N)=O)c2nnn(C)c(=O)c12,CS(C)=O,398.5
C[C@@H](O)CNc1ncnc2[nH]c(-c3ccccc3)c(-c3ccccc3)c12,CN(C)C=O,460.0
C[C@@H]1CC(C)(C)N(Cc2ccccc2)c2ccc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,CCO,470.0
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O,O,353.0
C[C@@]12CCCC(C1)C(c1ccccc1)N(N=O)C2c1ccccc1,CO,425.0
C[C@@]12CCCC(C1)C(c1ccccc1)N([N+](=O)[O-])C2c1ccccc1,CO,294.0
C[C@@]12SC(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)=CC1=C1CCCC1=C1C=C(/C=C(\C#N)C(=O)O)S[C@]12C,ClCCl,659.0
C[C@@]12SC(Cl)=CC1=c1nc(-c3ccccc3)[nH]c1=C1C=C(Cl)S[C@]12C,CC#N,322.0
C[C@H](Nc1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12)C(=O)OC(C)(C)C,ClCCl,462.0
C[C@H]1CC(C)(C)N(C)c2ccc(-c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)s3)cc21,CCO,455.0
C[C@H]1CC(C)(C)N(C)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,CCO,462.0
C[C@H]1CC(C)(C)N(C)c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)cc21,CCO,441.0
C[C@H]1CC(C)(C)N(C)c2ccc(/C=C/c3cc4sc5cc(/C=C(\C#N)C(=O)O)sc5c4s3)cc21,CCO,467.0
C[C@H]1CC(C)(C)N(C)c2ccc(/C=C/c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,CCO,472.0
C[C@H]1CC(C)(C)N(C)c2ccc(/C=C/c3ccc(/C=C(\C#N)P(=O)(O)O)s3)cc21,CCO,445.0
C[C@H]1CC(C)(C)N(C)c2ccc(/C=C/c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc21,CCO,492.0
C[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@@H]1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O,C1CCOC1,397.0
C[C@]12C(=O)NC(=O)N([C@H]3CC(O)[C@@H](CO)O3)[C@H]1[C@H]1Oc3cc4oc(=O)ccc4cc3[C@H]12,CC(C)O,327.0
C[C@]12C(=O)NC(=O)N([C@H]3CC(O)[C@@H](CO)O3)[C@H]1[C@H]1Oc3cc4oc(=O)ccc4cc3[C@H]12,CCO,327.0
C[C@]12C(=O)NC(=O)N([C@H]3CC(O)[C@@H](CO)O3)[C@H]1[C@H]1Oc3cc4oc(=O)ccc4cc3[C@H]12,CCOCC,325.0
C[C@]12C(=O)NC(=O)N([C@H]3CC(O)[C@@H](CO)O3)[C@H]1[C@H]1Oc3cc4oc(=O)ccc4cc3[C@H]12,CO,328.0
C[C@]12C(=O)NC(=O)N([C@H]3CC(O)[C@@H](CO)O3)[C@H]1[C@H]1Oc3cc4oc(=O)ccc4cc3[C@H]12,O,329.0
C[C@]12SC(=O)C=C1c1nc(-c3ccc(Cl)cc3Cl)[nH]c1C1=CC(=O)S[C@@]12C,CC#N,475.0
C[C@]12SC(=O)C=C1c1nc(-c3ccc(O)cc3)[nH]c1C1=CC(=O)S[C@@]12C,CC#N,470.0
C[C@]12SC(=O)C=C1c1nc(-c3ccccc3)[nH]c1C1=CC(=O)S[C@@]12C,CC#N,460.0
C[C@]12SC(=O)C=C1c1nc(-c3ccccc3O)[nH]c1C1=CC(=O)S[C@@]12C,CC#N,455.0
C[N+](C)=C1c2cccn2[B-](F)(F)n2cccc21,CCOC(C)=O,399.0
C[N+](C)=c1ccc2c(-c3c(Cl)c(Cl)c(Cl)c(Cl)c3C(=O)O)c3ccc4cc(O)ccc4c3oc-2c1,O,574.0
C[N+](C)=c1ccc2c(-c3c(F)c(F)c(F)c(F)c3C(=O)O)c3ccc4cc(O)ccc4c3oc-2c1,O,571.0
C[N+](C)=c1ccc2c(-c3c(F)c(F)c(F)c(F)c3C(=O)[O-])c3ccc4cc([O-])ccc4c3oc-2c1,O,603.0
C[N+](C)=c1ccc2c(-c3ccccc3C(=O)O)c3c(ccc4ccc(O)cc43)oc-2c1,O,560.0
C[N+](C)=c1ccc2c(-c3ccccc3C(=O)O)c3cc(F)c4cc(O)ccc4c3oc-2c1,O,575.0
C[N+](C)=c1ccc2c(-c3ccccc3C(=O)O)c3ccc4c(F)c(O)ccc4c3oc-2c1,O,582.0
C[N+](C)=c1ccc2c(-c3ccccc3C(=O)[O-])c3ccc4cc(N)ccc4c3oc-2c1,O,564.0
C[N+](C)=c1ccc2c(-c3ccccc3C(=O)[O-])c3ccc4cc([O-])ccc4c3oc-2c1,O,573.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N)c4F)C=C3CCC2)C(C)(C)c2ccccc21,CCO,690.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N)c4F)C=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,684.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCC(C(=O)O)CC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,CCO,620.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCC(C(=O)O)CC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,634.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCC(C(=O)O)CC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,O,619.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,CCO,707.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,721.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,O,717.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCC5CO)c4F)C=C3CCC2)C(C)(C)c2ccccc21,CCO,702.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCC5CO)c4F)C=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,720.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCC5CO)c4F)C=C3CCC2)C(C)(C)c2ccccc21,O,707.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,CCO,621.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,689.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,O,624.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,CCO,632.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,709.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCCCCC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,O,634.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCN(C(=O)OC(C)(C)C)CC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,CCO,608.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc(F)c(N5CCN(C(=O)OC(C)(C)C)CC5)c4F)C=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,626.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc5c6c4CCCN6CCC5)C(c4ccccc4C(=O)O)=C3CCC2)C(C)(C)c2ccccc21,CC#N,724.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc5c6c4CCCN6CCC5)C(c4ccccc4C(=O)O)=C3CCC2)C(C)(C)c2ccccc21,CCO,710.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc5c6c4CCCN6CCC5)C(c4ccccc4C(=O)O)=C3CCC2)C(C)(C)c2ccccc21,CO,714.0
C[N+]1=C(/C=C/C2=C3Oc4c(cc5c6c4CCCN6CCC5)C(c4ccccc4C(=O)O)=C3CCC2)C(C)(C)c2ccccc21,ClC(Cl)Cl,730.0
C[N+]1=C(/C=C/C=C2/N(CCC[N+](C)(C)C)c3ccc(S(=O)(=O)[O-])cc3C2(C)C)C(C)(C)c2ccccc21,CS(C)=O,556.0
C[N+]1=C(/C=C/C=C2/N(CCC[N+](C)(C)C)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CS(C)=O,552.0
C[N+]1=C(/C=C/C=C2/N(CCCc3ccccc3)c3ccccc3C2(C)C)C(C)(C)c2ccccc21,CS(C)=O,553.0
C[N+]1=C(/C=C/c2ccc(N(CCC(=O)O)CCC(=O)O)cc2)C(C)(C)C2=C1C=CC1C=CC=CC21,CCO,578.0
C[N+]1=C(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)C(C)(C)c2cc(C(=O)O)ccc21,CO,549.0
C[N+]1=C(/C=C2/C(=O)C(O)=C2[O-])C(C)(C)c2ccccc21,CCO,419.0
C[N+]1=C(/C=C2/C(=O)C(c3cc4c5c(c3)C(C)(C)c3cccc6c3N5c3c(cccc3C4(C)C)C6(C)C)=C2[O-])C(C)(C)c2cc(C(=O)O)ccc21,CC#N,643.0
C[N+]1=c2cc3c(cc2C(C)(C)CC1)=C(c1ccccc1C(=O)O)c1cc2c(cc1O3)Oc1cc3c(cc1=C2c1ccccc1C(=O)O)C(C)(C)CC[N+]=3C,ClC(Cl)Cl,590.0
C[N+]1=c2ccc3c(c2C(C)(C)CC1)Oc1cc2c(cc1C=3c1ccccc1C(=O)O)C(c1ccccc1C(=O)O)=c1ccc3c(c1O2)C(C)(C)CC[N+]=3C,ClC(Cl)Cl,617.0
C[NH+](C)c1c2ccccc2cc2ccccc12,O,389.0
C[NH+]=C1c2cccn2[B-](F)(F)n2cccc21,CCOC(C)=O,398.5
C[P+](c1c2ccccc2cc2ccccc12)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,C1CCOC1,430.0
C[P+](c1ccccc1)(c1ccccc1)c1c2ccccc2c(N(c2ccccc2)c2ccccc2)c2ccccc12,CC#N,496.0
C[P+](c1ccccc1)(c1ccccc1)c1c2ccccc2c(N(c2ccccc2)c2ccccc2)c2ccccc12,CO,499.0
C[P+](c1ccccc1)(c1ccccc1)c1c2ccccc2c(N(c2ccccc2)c2ccccc2)c2ccccc12,ClCCl,519.0
C[P+](c1ccccc1)(c1ccccc1)c1c2ccccc2c(N(c2ccccc2)c2ccccc2)c2ccccc12,O,489.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,CC#N,380.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,CO,383.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,ClCCl,402.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,O,373.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,CC#N,414.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,CO,415.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,ClCCl,438.0
C[P+](c1ccccc1)(c1ccccc1)c1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12,O,410.0
C[P+]1(c2ccccc2)C2=C(c3ccccc31)S(=O)(=O)c1ccccc12,CC#N,388.0
C[P+]1(c2ccccc2)C2=C(c3ccccc31)S(=O)(=O)c1ccccc12,CCO,319.0
C[P+]1(c2ccccc2)C2=C(c3ccccc31)S(=O)(=O)c1ccccc12,ClCCl,395.0
C[P+]1(c2ccccc2)c2ccccc2-c2sc3ccccc3c21,CC#N,335.0
C[P+]1(c2ccccc2)c2ccccc2-c2sc3ccccc3c21,CCO,336.0
C[P+]1(c2ccccc2)c2ccccc2-c2sc3ccccc3c21,ClCCl,340.0
C[S+](C)CC(=O)[O-],O,432.0
C[SiH](C)c1ccc([SiH](C)C)c2ccccc12,C1CCCCC1,300.0
C[SiH]1c2ccccc2-c2cc3c(cc21)-c1ccccc1[SiH]3C,ClCCl,324.0
C[Si](C)(C#CC1=C(c2ccccc2)C(c2ccccc2)=C(C#C[Si](C)(C)c2ccccc2)[Si]1(C)c1ccccc1)c1ccccc1,C1CCOC1,210.0
C[Si](C)(C)C#CC#Cc1ccc2c3cccc4cccc(c5cccc1c52)c43,C1CCCCC1,470.0
C[Si](C)(C)C#CC(C#C[Si](C)(C)C)=Cc1ccc(C=C(C#C[Si](C)(C)C)C#C[Si](C)(C)C)s1,ClC(Cl)Cl,458.0
C[Si](C)(C)C#CC1=CC2=c3cc(C#C[Si](C)(C)C)c4nc(C(F)(F)C(F)(F)C(F)(F)F)nc5c(C#C[Si](C)(C)C)cc(c3c54)C3=CC(C#C[Si](C)(C)C)=C4N=C(C(F)(F)C(F)(F)C(F)(F)F)N=C1C4C32,C1CCOC1,512.0
C[Si](C)(C)C#C[Si](c1c2ccccc2cc2ccccc12)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,ClC(Cl)Cl,404.0
C[Si](C)(C)C#Cc1c2c(=O)c3ccccc3c2c(C#C[Si](C)(C)C)c2c(=O)c3ccccc3c12,ClC(Cl)Cl,524.0
C[Si](C)(C)C#Cc1cc2ccc3cc(C#C[Si](C)(C)C)cc4ccc(c1)c2c34,Cc1ccccc1,407.0
C[Si](C)(C)C#Cc1ccc(C#C[Si](C)(C)C)c2ccccc12,C1CCCCC1,347.0
C[Si](C)(C)C#Cc1ccc(C(=O)c2cc(C#C[Si](C)(C)C)c3ccc4c(C#C[Si](C)(C)C)cc(C#C[Si](C)(C)C)c5ccc2c3c45)cc1,CCCCCC,415.0
C[Si](C)(C)C#Cc1ccc2c3cccc4cccc(c5cccc1c52)c43,C1CCCCC1,459.0
C[Si](C)(C)C#Cc1cccc2ccccc12,C1CCCCC1,316.0
C[Si](C)(C)O[Si]1(O[Si](C)(C)C)n2c3c4ccccc4c2/N=C2\N=C(/N=c4/c5ccccc5/c(n41)=N/C1=N/C(=N\3)c3ccccc31)c1ccccc12,CN(C)C=O,668.0
C[Si](C)(C)[Si](C)(C)c1ccc2cc3ccccc3cc2c1,C1CCCCC1,382.6833157
C[Si](C)(C)[Si](c1cc2sc([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)cc2s1)([Si](C)(C)C)[Si](C)(C)C,ClCCl,309.0
C[Si](C)(C)[Si](c1cc2sc3cc([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)sc3c2s1)([Si](C)(C)C)[Si](C)(C)C,ClCCl,334.0
C[Si](C)(C)[Si](c1ccc(-c2ccc([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)s2)s1)([Si](C)(C)C)[Si](C)(C)C,ClCCl,350.0
C[Si](C)(C)[Si](c1ccc([Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C)s1)([Si](C)(C)C)[Si](C)(C)C,ClCCl,285.0
C[Si](C)(C)c1cc2c(cc3ccc4cccc5ccc2c3c45)[nH]1,CCOC(C)=O,392.0
C[Si](C)(C)c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc([Si](C)(C)C)cc5)cc4)c4nsnc34)cc2)cc1,C1CCOC1,401.0
C[Si](C)(C)c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc([Si](C)(C)C)cc5)s4)c4nsnc34)s2)cc1,C1CCOC1,495.0
C[Si](C)(C)c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc([Si](C)(C)C)s5)cc4)c4nsnc34)cc2)s1,C1CCOC1,415.0
C[Si](C)(C)c1ccc(C#N)c2ccccc12,C1CCCCC1,315.0
C[Si](C)(C)c1ccc([Si](C)(C)C)c2ccccc12,C1CCCCC1,300.0
C[Si](C)(C)c1ccc2ccc3c([Si](C)(C)C)cc(C=O)c4ccc1c2c43,CO,398.0
C[Si](C)(C)c1ccc2ccc3c([Si](C)(C)C)cc(C=O)c4ccc1c2c43,ClCCl,403.0
C[Si](C)(C)c1ccc2ccc3c([Si](C)(C)C)ccc4ccc1c2c43,CCCCCC,350.0
C[Si](C)(C)c1ccc2ccc3c([Si](C)(C)C)ccc4ccc1c2c43,CO,349.0
C[Si](C)(C)c1ccc2ccc3c([Si](C)(C)C)ccc4ccc1c2c43,ClCCl,352.0
C[Si](C)(C)c1cccc2c(C#N)cccc12,C1CCCCC1,311.0
C[Si](C)(C)c1cccc2ccccc12,C1CCCCC1,294.0
C[Si](C)(C)c1sc([Si](C)(C)C)c2c1sc1c2sc2sc3sc4c(sc5c([Si](C)(C)C)sc([Si](C)(C)C)c54)c3c21,ClC(Cl)Cl,332.0
C[Si](C)(C)c1sc([Si](C)(C)C)c2c1sc1c3sc4c(sc5c4sc4c([Si](C)(C)C)sc([Si](C)(C)C)c45)c3sc12,ClC(Cl)Cl,405.0
C[Si](C)(C)c1sc([Si](C)(C)C)c2c1sc1ccsc12,ClC(Cl)Cl,310.0
C[Si](C)(C=C[Si](C)(C)[Si]([Si](C)(C)C=C[Si](C)(C)c1ccc(-c2cccs2)s1)([Si](C)(C)C=C[Si](C)(C)c1ccc(-c2cccs2)s1)[Si](C)(C)C=C[Si](C)(C)c1ccc(-c2cccs2)s1)c1ccc(-c2cccs2)s1,C1COCCO1,311.0
C[Si](C)(C=Cc1ccc(-c2cccc3[nH]c4ccccc4c23)cc1)c1ccccc1-c1c2ccccc2c(-c2ccccc2[Si](C)(C)C=Cc2ccc(-c3cccc4[nH]c5ccccc5c34)cc2)c2ccccc12,ClCCl,328.0
C[Si](C)(c1ccc(-c2c3ccccc3c(-c3ccc([Si](C)(C)c4ccc5ccc6cccc7ccc4c5c67)cc3)c3ccccc23)cc1)c1ccc2ccc3cccc4ccc1c2c34,ClCCl,297.0
C[Si](C)(c1ccc(-c2cccc3[nH]c4ccccc4c23)cc1)c1ccccc1-c1c2ccccc2c(-c2ccccc2[Si](C)(C)c2ccc(-c3cccc4[nH]c5ccccc5c34)cc2)c2ccccc12,ClCCl,293.0
C[Si](C)(c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1)c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1,ClCCl,302.0
C[Si](C)(c1ccc2cc3ccccc3cc2c1)[Si](C)(C)c1ccc2cc3ccccc3cc2c1,C1CCCCC1,381.2468885
C[Si](C)(c1cccc2cc3ccccc3cc12)[Si](C)(C)c1cccc2cc3ccccc3cc12,C1CCCCC1,385.8221752
C[Si](c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1)(c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1)c1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1,ClCCl,307.0
C[Si]1(C)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)P(=O)(c1ccccc1)c1ccccc12,CC#N,440.0
C[Si]1(C)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)P(=O)(c1ccccc1)c1ccccc12,CO,452.0
C[Si]1(C)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)P(=O)(c1ccccc1)c1ccccc12,Cc1ccccc1,446.0
C[Si]1(C)C2=C(c3ccccc31)S(=O)(=O)c1cc3c(cc12)S(=O)(=O)C1=C3[Si](C)(C)c2ccccc21,C1CCOC1,468.0
C[Si]1(C)O[Si](C)(C)c2cc3c(-c4ccc(F)cc4)c4ccccc4nc3cc21,ClCCl,368.0
C[Si]1(C)O[Si](C)(C)c2cc3c(-c4ccccc4)c4cc(Cl)ccc4nc3cc21,ClCCl,376.0
C[Si]1(C)O[Si](C)(C)c2cc3c(-c4ccccc4)c4cc([N+](=O)[O-])ccc4nc3cc21,ClCCl,376.0
C[Si]1(C)O[Si](C)(C)c2cc3c(-c4ccccc4)c4ccccc4nc3cc21,ClCCl,368.0
C[Si]1(C)O[Si](C)(C)c2cc3c(-c4ccccc4F)c4cc(Cl)ccc4nc3cc21,ClCCl,380.0
C[Si]1(C)O[Si](C)(C)c2cc3cc4c(cc3cc21)C(=O)c1cc2cc3c(cc2cc1C4=O)[Si](C)(C)O[Si]3(C)C,ClC(Cl)Cl,417.0
C[Si]1(C)O[Si](C)(C)c2cc3cc4cc5c(cc4cc3cc21)C(=O)c1cc2cc3cc4c(cc3cc2cc1C5=O)[Si](C)(C)O[Si]4(C)C,ClC(Cl)Cl,470.0
C[Si]1(C)O[Si](C)(C)c2cc3nc4ccc(Cl)cc4c(-c4ccccc4)c3cc2[Si](C)(C)O1,ClCCl,373.0
C[Si]1(C)O[Si](C)(C)c2cc3nc4ccccc4c(-c4ccccc4)c3cc2[Si](C)(C)O1,ClCCl,368.0
C[Si]1(C)c2cc(-c3ccc(-c4cccs4)s3)ccc2C=Cc2ccc(-c3ccc(-c4cccs4)s3)cc21,ClCCl,458.0
C[Si]1(C)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc2C=Cc2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,435.0
C[Si]1(C)c2cc(-c3cccs3)ccc2C=Cc2ccc(-c3cccs3)cc21,ClCCl,408.0
C[Si]1(C)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc21,ClCCl,495.0
C[Si]1(C)c2cc(/C=C(\C#N)C(=O)O)sc2-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,CCO,463.0
C[Si]1(C)c2cc(C#Cc3ccccc3)ccc2C=Cc2ccc(C#Cc3ccccc3)cc21,ClCCl,403.0
C[Si]1(C)c2cc3c(cc2-c2sc4ccccc4c21)[Si](C)(C)c1c-3sc2ccccc12,C1CCOC1,409.0
C[Si]1(C)c2cc3c(cc2C(c2ccccc2C(=O)O)=c2cc4c(cc21)=[NH+]CCC4)CCCN3,O,637.0
C[Si]1(C)c2ccc(-c3ccc(-c4cccs4)s3)cc2C=Cc2cc(-c3ccc(-c4cccs4)s3)ccc21,ClCCl,398.0
C[Si]1(C)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2C=Cc2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,390.0
C[Si]1(C)c2ccc(-c3ccccc3)cc2C=Cc2cc(-c3ccccc3)ccc21,ClCCl,338.0
C[Si]1(C)c2ccc(-c3cccs3)cc2C=Cc2cc(-c3cccs3)ccc21,ClCCl,354.0
C[Si]1(C)c2ccc(C#Cc3ccccc3)cc2C=Cc2cc(C#Cc3ccccc3)ccc21,ClCCl,346.0
C[Si]1(C)c2ccccc2-c2cc3c(cc21)-c1ccccc1[Si]3(C)C,ClCCl,322.0
C[Si]1(C)c2ccccc2-c2sc3cc4c5c(sc4cc3c21)-c1ccccc1[Si]5(C)C,C1CCOC1,401.0
C[Si]1(c2ccccc2)C(c2ccc(-n3c4ccccc4c4ccccc43)cc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,385.0
C[Si]1(c2ccccc2)C(c2ccc3c(c2)c2ccccc2n3-c2ccccc2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc2c(c1)c1ccccc1n2-c1ccccc1,C1CCOC1,404.0
C[Si]1(c2ccccc2)C(c2ccc3c4ccccc4n(-c4ccccc4)c3c2)=C(c2ccccc2)C(c2ccccc2)=C1c1ccc2c3ccccc3n(-c3ccccc3)c2c1,C1CCOC1,398.0
C[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(N)cc21,O,478.0
C[n+]1c2c(c(-c3ccccc3)c3c1CCCC3)CCCC2,CCO,340.0259067
C[n+]1ccc(-c2cc[n+](C)cc2)cc1,CC#N,260.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,CC#N,472.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,CC(C)=O,479.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,CC(C)O,457.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,CCC(C)O,460.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,CCCO,441.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,CO,418.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,CS(C)=O,473.0
C[n+]1ccc(-c2ccc([O-])cc2)cc1,O,394.0
C[n+]1ccc(-c2nc3sc(-c4cc[n+](C)cc4)nc3s2)cc1,O,390.0
C[n+]1ccc(/C=C/c2cc[n+](C)cc2)cc1,CC#N,317.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CC#N,569.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CC(C)=O,585.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CC(C)O,544.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CCCO,523.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CCO,515.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CN(C)C=O,580.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CO,484.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,CS(C)=O,573.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,ClCCl,595.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,NC=O,494.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,O,442.0
C[n+]1ccc(/C=C/c2ccc([O-])cc2)cc1,OCCO,474.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,C1CCOC1,412.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CC#N,400.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CC(=O)OC(C)=O,403.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CC(C)=O,406.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CC(C)O,426.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CCCCCCCCO,426.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CCCCO,424.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CCO,416.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CO,409.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,CS(C)=O,408.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,ClC(Cl)Cl,424.0
C[n+]1ccc(/C=C/c2ccc3cc(O)ccc3c2)cc1,O,390.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CC#N,577.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CC(C)=O,622.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CC(C)O,536.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CCCCCCCCO,555.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CCCCO,555.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CCO,515.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CO,486.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,CS(C)=O,605.0
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,ClC(Cl)Cl,412.0151372
C[n+]1ccc(/C=C/c2ccc3cc([O-])ccc3c2)cc1,O,448.0
C[n+]1ccc2c(ccc3c[n+](C)c4ccc5ccccc5c4c32)c1,CC#N,470.0
C[n+]1ccn(CCCCc2ccc3c(c2)c2ccccc2n3-c2cc(C#N)c(C#N)cc2F)c1,CC#N,350.7889546
C[n+]1ccnc(/C=C/c2ccc(N(c3ccccc3)c3ccc(/C=C/c4c[n+](C)ccn4)cc3)cc2)c1,CS(C)=O,440.0
C[n+]1ccnc(/C=C/c2ccc(N(c3ccccc3)c3ccc(/C=C/c4c[n+](C)ccn4)cc3)cc2)c1,O,485.0
C[n+]1ccnc(/C=C/c2ccc(N(c3ccccc3)c3ccc(/C=C/c4c[n+](C)ccn4)cc3)cc2)c1,OCC(O)CO,500.0
Cc1[nH]c2ccccc2c1N=Nc1n[nH]c(S)n1,CS(C)=O,388.0
Cc1[nH]c2ccccc2c1N=Nc1nncs1,CS(C)=O,469.0
Cc1[nH]n(-c2ccccc2)c(=O)c1-n1nc2ccc(Cl)cc2n1,CCO,326.0
Cc1c(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)c(=O)oc2cc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc12,CCO,431.0
Cc1c(-c2ccc(/C=C(\C#N)C(=O)O)s2)c(=O)oc2cc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc12,CCO,429.0
Cc1c(-c2ccc(/C=C/c3ccc(/C=C(/C#N)C(=O)O)s3)s2)c(=O)oc2cc(N(c3ccc4c(c3)C(C)(C)c3ccccc3-4)c3ccc4c(c3)C(C)(C)c3ccccc3-4)ccc12,CCO,450.0
Cc1c(-c2ccc(CCC(=O)O)cc2)c(/C=C/C2=C(C#N)C(=C(C#N)C#N)OC2(C)C)n2ccccc12,ClCCl,636.0
Cc1c(-c2ccc(CO)cc2)c(/C=C/c2ccc(/C=C(\C#N)C(=O)O)s2)n2ccccc12,ClCCl,573.0
Cc1c(-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2)ncnc1-c1ccc(N2c3ccccc3C(C)(C)c3ccccc32)cc1,Cc1ccccc1,367.5
Cc1c(-c2ccccc2)c(-c2ccc(/C=C(\C#N)C(=O)O)s2)n2ccccc12,ClCCl,557.0
Cc1c(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc(-n2c3ccccc3c3cc4c(cc32)C2c3ccccc3C4c3ccccc32)c1C,Cc1ccccc1,344.0
Cc1c(-c2nnc(-c3c4ccccc4cc4ccccc34)o2)sc2sc(-c3nnc(-c4c5ccccc5cc5ccccc45)o3)c(C)c12,CCO,400.0
Cc1c(-c2nnc(-c3ccco3)o2)sc2sc(-c3nnc(-c4ccco4)o3)c(C)c12,CCO,359.0
Cc1c(-c2nnc(-c3cccs3)o2)sc2sc(-c3nnc(-c4cccs4)o3)c(C)c12,CCO,355.0
Cc1c(-c2nnc(C=Cc3ccccc3)o2)sc2sc(-c3nnc(C=Cc4ccccc4)o3)c(C)c12,CCO,364.0
Cc1c(C(=O)C=Cc2cc(Cl)cc(Cl)c2)nnn1-c1ccnc2cc(Cl)ccc12,CO,236.0
Cc1c(C(=O)C=Cc2ccc(Br)cc2)nnn1-c1ccnc2cc(Cl)ccc12,CO,235.0
Cc1c(C(=O)C=Cc2ccc(C#N)cc2)nnn1-c1ccnc2cc(Cl)ccc12,CO,235.0
Cc1c(C(=O)C=Cc2ccc(C(F)(F)F)cc2)nnn1-c1ccnc2cc(Cl)ccc12,CO,236.0
Cc1c(C(=O)C=Cc2ccc(Cl)cc2)nnn1-c1ccnc2cc(Cl)ccc12,CO,235.0
Cc1c(C(=O)C=Cc2ccc(F)cc2)nnn1-c1ccnc2cc(Cl)ccc12,CO,237.0
Cc1c(C(=O)C=Cc2ccc(N(C)C)cc2)nnn1-c1ccnc2cc(Cl)ccc12,CO,237.0
Cc1c(C(=O)C=Cc2ccc(OCCCN3CCOCC3)cc2)nnn1-c1ccnc2cc(Cl)ccc12,CO,237.0
Cc1c(C(=O)C=Cc2ccc3c(c2)OCO3)nnn1-c1ccnc2cc(Cl)ccc12,CO,236.0
Cc1c(C(=O)C=Cc2cccc([N+](=O)[O-])c2)nnn1-c1ccnc2cc(Cl)ccc12,CO,233.0
Cc1c(C(=O)C=Cc2ccco2)nnn1-c1ccnc2cc(Cl)ccc12,CO,234.0
Cc1c(C(=O)O)c(O)cc2c1C(=O)c1c(O)c(C3OC(CO)C(O)C(O)C3O)c(O)c(O)c1C2=O,CCO,500.0
Cc1c(C(=O)ON2C(=O)C=CC2=O)c(=O)oc2c(F)c(O)c(F)cc12,O,416.0
Cc1c(C(=O)c2c(F)cc(F)cc2F)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,390.0
Cc1c(C(=O)c2ccc(C(F)(F)F)cc2)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,370.0
Cc1c(C(=O)c2ccc3c4cccc5cccc(c6cccc2c63)c54)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,468.0
Cc1c(C(=O)c2ccc3ccc4cccc5ccc2c3c45)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,391.0
Cc1c(C(=O)c2ccccc2)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,391.0
Cc1c(C(=O)c2ccccc2Cl)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,390.0
Cc1c(C(N)=O)c(=O)oc2cc3c(cc12)nc(Nc1ccc(Cl)c(Cl)c1)n3CCCN1CCCC1=O,CCO,364.0
Cc1c(C(N)=O)c(=O)oc2cc3c(cc12)nc(Nc1cccc(Br)c1)n3CCOc1ccccc1,CCO,363.0
Cc1c(C(N)=O)c(=O)oc2cc3c(cc12)nc(Nc1cccc(Cl)c1)n3Cc1ccccn1,CCO,360.0
Cc1c(C(N)=O)c(=O)oc2cc3c(cc12)nc(Nc1cccc(F)c1)n3CCCn1ccnc1,CCO,365.0
Cc1c(C)c(-c2ccc(-c3cccnc3)cc2)c(C)c(C)c1B(c1c(C)c(C)c(-c2ccc(-c3cccnc3)cc2)c(C)c1C)c1c(C)c(C)c(-c2ccc(-c3cccnc3)cc2)c(C)c1C,ClCCl,331.0
Cc1c(C)c(-c2cccnc2)c(C)c(C)c1B(c1c(C)c(C)c(-c2cccnc2)c(C)c1C)c1c(C)c(C)c(-c2cccnc2)c(C)c1C,ClCCl,330.0
Cc1c(C)c(B(c2c(C)c(C)c(C#N)c(C)c2C)c2c(C)c(C)c(N3c4ccccc4Oc4ccccc43)c(C)c2C)c(C)c(C)c1C#N,c1ccc([Si](c2ccccc2)(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,420.0
Cc1c(C)c(C)c2c(c1C)COc1ccccc1C#Cc1ccccc1OC2,ClCCl,315.0
Cc1c(C)c(N2c3ccccc3Oc3ccccc32)c(C)c(C)c1B(c1c(C)c(C)c(N2c3ccccc3Oc3ccccc32)c(C)c1C)c1c(C)c(C)c(N2c3ccccc3Oc3ccccc32)c(C)c1C,CC(C)(C)c1ccc(-n2c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1,398.0
Cc1c(C)c2c3ccccc3[nH]c2c2ccccc12,ClCCl,302.0
Cc1c(C)c2cc3cc4ccccc4cc3n2c2nc3cc4ccccc4cc3cc12,ClCCl,517.0
Cc1c(C)c2cc3cc4ccccc4cc3n2c2nc3ccccc3cc12,ClCCl,483.0
Cc1c(C)c2cc3ccccc3n2c2nc3cc4ccccc4cc3cc12,ClCCl,479.0
Cc1c(C)c2cc3ccccc3n2c2nc3ccccc3cc12,ClCCl,442.0
Cc1c(C)n2c(CN)c(C)c(=O)n2c1=O,CO,375.0
Cc1c(C)n2c(CNC(=O)CI)c(C)c(=O)n2c1=O,CO,375.0
Cc1c(C)n2c(COC(=O)CNC(=O)OC(C)(C)C)c(C)c(=O)n2c1=O,CCO,374.0
Cc1c(C)n2c(COC(=O)c3ccc(F)cc3)c(C)c(=O)n2c1=O,CCO,375.0
Cc1c(C)n2c(COC(=O)c3ccccc3I)c(C)c(=O)n2c1=O,CCO,377.0
Cc1c(C)n2c(COC(=O)c3ccccc3O)c(C)c(=O)n2c1=O,CCO,379.0
Cc1c(C)n2c(CSCC(=O)O)c(C)c(=O)n2c1=O,CO,380.0
Cc1c(C2=[N+]3C(=Cc4c(C)c5ccccc5n4[B-]3(F)F)c3ccccc32)[nH]c2ccccc12,C1CCOC1,608.0
Cc1c(C2=[N+]3C(=Cc4c(C)c5ccccc5n4[B-]3(F)F)c3ccccc32)[nH]c2ccccc12,CC#N,591.0
Cc1c(C2=[N+]3C(=Cc4c(C)c5ccccc5n4[B-]3(F)F)c3ccccc32)[nH]c2ccccc12,CCCCCC,623.0
Cc1c(C2=[N+]3C(=Cc4c(C)c5ccccc5n4[B-]3(F)F)c3ccccc32)[nH]c2ccccc12,CO,598.0
Cc1c(C2=[N+]3C(=Cc4c(C)c5ccccc5n4[B-]3(F)F)c3ccccc32)[nH]c2ccccc12,Cc1ccccc1,625.0
Cc1c(C2=[N+]3C(=Cc4c(C)c5ccccc5n4[B-]3(F)F)c3ccccc32)[nH]c2ccccc12,ClCCl,611.0
Cc1c(CC(=O)O)c(=O)oc2cc(N)c(S(=O)(=O)O)cc12,O,340.0
Cc1c(CC(=O)ON2C(=O)C=CC2=O)c(=O)oc2c(F)c(O)c(F)cc12,O,362.0
Cc1c(COC(=O)Cc2cccc3ccccc23)n2c(OCC(=O)Cc3cccc4ccccc34)c(C)c(=O)n2c1=O,CCO,379.0
Cc1c(COC(=O)Cc2ccccc2)n2c(OCC(=O)Cc3ccccc3)c(C)c(=O)n2c1=O,CCO,379.0
Cc1c(COC(=O)c2ccc(I)cc2)n2c(OCC(=O)c3ccc(I)cc3)c(C)c(=O)n2c1=O,CCO,387.0
Cc1c(COC(=O)c2ccccc2)n2c(OCC(=O)c3ccccc3)c(C)c(=O)n2c1=O,CCO,381.0
Cc1c(COC(=O)c2ccccc2Br)n2c(OCC(=O)c3ccccc3Br)c(C)c(=O)n2c1=O,CCO,382.0
Cc1c(COC(=O)c2ccccc2Cl)n2c(OCC(=O)c3ccccc3Cl)c(C)c(=O)n2c1=O,CCO,381.0
Cc1c(N2C(=O)C=CC2=O)c(=O)oc2cc(N(C)C)ccc12,CO,383.0
Cc1c(N=Nc2n[nH]c(S)n2)c2ccccc2n1C,CS(C)=O,402.0
Cc1c(N=Nc2nc(-c3cc4ccccc4oc3=O)cs2)c2ccccc2n1C,CS(C)=O,462.0
Cc1c(N=Nc2nc3ccccc3s2)c2ccccc2n1C,ClC(Cl)Cl,507.0
Cc1c(N=Nc2nncs2)c2ccccc2n1C,CS(C)=O,441.0
Cc1c(NC(=O)CI)c(=O)oc2cc(N(C)C)ccc12,CO,376.0
Cc1c(O)ccc(N=Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1O,CC(C)=O,408.0
Cc1c(O)ccc(N=Nc2ccc([N+](=O)[O-])cc2C#N)c1O,CC(C)=O,441.0
Cc1c(O)ccc(N=Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1O,CC(C)=O,423.0
Cc1c(O)ccc(N=Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1O,CC(C)=O,418.0
Cc1c(O)ccc2c(=O)c(-c3ccc(O)cc3)coc12,O,287.0
Cc1c2c(c(C)c3ccccc13)-c1cc3nc4ccccc4nc3cc1-2,ClC(Cl)Cl,448.0
Cc1c2c(c(C)c3ccccc13)C1=C2C=CC2Nc3ccccc3NC12,ClC(Cl)Cl,437.0
Cc1c2c(c(C)c3ccccc13)C1=CC3Nc4ccccc4NC3C=C12,ClC(Cl)Cl,470.0
Cc1c2c(n3ccc(-c4ccccc4)cc13)C(=O)N(C(C)CO)C2,ClCCl,349.0
Cc1c2c(n3ccc(C#N)cc13)C(=O)N(C(C)CO)C2,ClCCl,342.0
Cc1c2c(n3ccccc13)C(=O)N(C(C)CO)C2,ClCCl,326.0
Cc1c2c(nc3ccccc13)-c1cc3c(cc1CC2)-c1nc2ccccc2c(C)c1CC3,ClC(Cl)Cl,372.0
Cc1c2cc3c(-c4ccccc4)c4c(c(-c5ccccc5)c3cc2c2n1[B-](F)(F)[n+]1c(C)c3cc5c(-c6ccccc6)c6c7cccc8cccc(c6c(-c6ccccc6)c5cc3c1=C2c1ccccc1)c87)-c1cccc2cccc-4c12,ClCCl,765.0
Cc1c2ccc3c(C)[n+](C)ccc3c2cc[n+]1C,CC#N,390.0
Cc1c2ccccc2c(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c2ccccc12,CC#N,502.0
Cc1c2ccccc2c(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c2ccccc12,CCCCCC,504.0
Cc1c2ccccc2c(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c2ccccc12,CCO,503.0
Cc1c2ccccc2c(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c2ccccc12,CN(C)C=O,506.0
Cc1c2ccccc2c(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c2ccccc12,Cc1ccccc1,508.0
Cc1c2ccccc2c(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)c2ccccc12,ClCCl,506.0
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,C1CCCCC1,290.0
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,C1CCOC1,293.3
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,C1COCCO1,292.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CC#N,291.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CC(C)(C)O,294.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CC(C)O,294.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CCC(C)(C)O,294.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CCCCCC,289.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CCCCO,295.0
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CCO,294.0
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CCOC(C)=O,291.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CCOCC,291.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CN(C)C=O,293.5
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CO,294.0
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,CS(C)=O,295.0
Cc1c2ccncc2c(C)c2c1[nH]c1ccccc12,Cc1ccccc1,293.0
Cc1c2oc(-c3ccc(-c4ccc(C#N)cc4)cc3)c(-c3ccc(-c4ccc(C#N)cc4)cc3)c2c(C)c2oc(-c3ccc(-c4ccc(C#N)cc4)cc3)c(-c3ccc(-c4ccc(C#N)cc4)cc3)c12,ClCCl,275.0
Cc1c2oc(-c3ccc(-c4ccc(C=O)cc4)cc3)c(-c3ccc(-c4ccc(C=O)cc4)cc3)c2c(C)c2oc(-c3ccc(-c4ccc(C=O)cc4)cc3)c(-c3ccc(-c4ccc(C=O)cc4)cc3)c12,ClCCl,288.0
Cc1c2oc(-c3ccc(-c4cccc5ccccc45)cc3)c(-c3ccc(-c4cccc5ccccc45)cc3)c2c(C)c2oc(-c3ccc(-c4cccc5ccccc45)cc3)c(-c3ccc(-c4cccc5ccccc45)cc3)c12,ClCCl,292.0
Cc1c2oc(-c3ccc(-c4ccccc4)cc3)c(-c3ccc(-c4ccccc4)cc3)c2c(C)c2oc(-c3ccc(-c4ccccc4)cc3)c(-c3ccc(-c4ccccc4)cc3)c12,ClCCl,261.0
Cc1c2oc(-c3ccc(-c4ccoc4)cc3)c(-c3ccc(-c4ccoc4)cc3)c2c(C)c2oc(-c3ccc(-c4ccoc4)cc3)c(-c3ccc(-c4ccoc4)cc3)c12,ClCCl,260.0
Cc1c2oc(-c3ccc(Br)cc3)c(-c3ccc(Br)cc3)c2c(C)c2oc(-c3ccc(Br)cc3)c(-c3ccc(Br)cc3)c12,ClCCl,228.0
Cc1c2oc(-c3ccccc3)c(-c3ccccc3)c2c(C)c2oc(-c3ccccc3)c(-c3ccccc3)c12,ClCCl,229.0
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,C1CCOC1,524.9261166
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CC#N,516.0278242
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CC(=O)O,520.998859
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CC(C)=O,522.6872396
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CCCCO,532.668563
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CCCCOC(C)=O,524.0650679
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CCCO,533.2252663
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CCN(CC)CC,534.8880747
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CCO,531.9346997
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CCOC(C)=O,522.6244107
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CN(C)C=O,535.1829255
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CO,529.7002956
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,CS(C)=O,540.289379
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,Cc1ccccc1,528.4406772
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,ClC(Cl)Cl,520.1208761
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,ClCCCl,517.1887687
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,O,514.1731838
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,O=[N+]([O-])c1ccccc1,533.9969135
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,c1ccccc1,522.1141446
Cc1c2oc3c(C)c(N)cc(C(=O)NC4OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C5CCCN5C(=O)C(C(C)C)NC4=O)c3nc-2c(C(=O)NC2OC(=O)C(C(C)C)N(C)C(=O)CN(C)C(=O)C3CCCN3C(=O)C(C(C)C)NC2=O)c(N)c1=O,c1ccncc1,541.1606814
Cc1c[nH]c(=O)[nH]c1=O,CC#N,261.0
Cc1cc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)ccc1F,O,482.5
Cc1cc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(C)C)ccc23)ccc1F,O,527.5
Cc1cc(-c2c3ccc(=[NH2+])cc-3oc3cc(N)ccc23)ccc1F,O,502.5
Cc1cc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)ccc1F,O,537.5
Cc1cc(-c2c3ccc(=[NH2+])cc-3oc3cc(O)ccc23)ccc1F,O,495.0
Cc1cc(-c2c3ccc(=[NH2+])cc-3sc3cc(N)ccc23)ccc1F,O,520.0
Cc1cc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)c(C)cc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,398.0
Cc1cc(-c2ccc(-c3ccccc3)cc2)cc(C)[o+]1,ClCCl,402.0
Cc1cc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,C1CCOC1,341.0
Cc1cc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,CN(C)C=O,317.0
Cc1cc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,Cc1ccccc1,341.0
Cc1cc(-c2ccc(-c3ccccc3)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,ClC(Cl)Cl,313.0
Cc1cc(-c2ccc(-c3n(C)c4ccccc4[n+]3C)cc2)ccc1-c1ccc(-c2n(C)c3ccccc3[n+]2C)cc1,O,299.0
Cc1cc(-c2ccc(-c3nc4ccccc4[nH]3)cc2)c(C)cc1-c1ccc(-c2nc3ccccc3[nH]2)cc1,CN(C)C=O,323.0
Cc1cc(-c2ccc(-c3nc4ccccc4[nH]3)cc2)ccc1-c1ccc(-c2nc3ccccc3[nH]2)cc1,CN(C)C=O,330.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-c3ccccc3)cc2)n1,C1CCOC1,341.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-c3ccccc3)cc2)n1,CN(C)C=O,341.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-c3ccccc3)cc2)n1,Cc1ccccc1,341.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-c3ccccc3)cc2)n1,ClC(Cl)Cl,341.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,C1CCOC1,341.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,CN(C)C=O,342.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,Cc1ccccc1,342.0
Cc1cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,ClC(Cl)Cl,342.0
Cc1cc(-c2ccc(/C=C(/C#N)C(=O)O)s2)c2nsnc2c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,453.0
Cc1cc(-c2ccc(/C=C(\C#N)C(=O)O)cc2)c2nsnc2c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,428.0
Cc1cc(-c2ccc(C(C)(C)C)cc2)c2nsnc2c1-c1ccc(C(C)(C)C)cc1,ClCCl,376.0
Cc1cc(-c2ccc(C(C)(C)C)cc2)c2nsnc2c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,402.0
Cc1cc(-c2ccc(C(C)(C)C)cc2)cc(C)[o+]1,CC#N,345.0
Cc1cc(-c2ccc(C(C)(C)C)cc2)cc(C)[o+]1,ClCCl,365.0
Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2nsnc2c1-c1ccc(/C=C(/C#N)C(=O)O)s1,ClCCl,452.0
Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2nsnc2c1-c1ccc(/C=C(\C#N)C(=O)O)cc1,ClCCl,428.0
Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2nsnc2c1-c1ccc(C(C)(C)C)cc1,ClCCl,418.0
Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2nsnc2c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,432.0
Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc(-c2ncc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)o2)c1O,Cc1ccccc1,310.0
Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)ccc1C1=CN/C(=C2/C=C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)C=CC2=O)O1,Cc1ccccc1,370.0
Cc1cc(-c2ccc3ccccc3c2)cc(C)[o+]1,ClCCl,430.0
Cc1cc(-c2cccc3ccccc23)cc(C)[o+]1,ClCCl,438.0
Cc1cc(-c2ccccc2)[o+]c2cc(N(C)C)ccc12,ClCCl,510.0
Cc1cc(-c2ccccc2)cc(C)[o+]1,CC#N,326.0
Cc1cc(-c2ccccc2)cc(C)[o+]1,ClCCl,343.0
Cc1cc(-c2ccccc2)nc2c1ccc1nc(-c3ccccc3)cn12,CC#N,347.0
Cc1cc(-c2ccccc2)nc2c1ccc1nc(-c3ccccc3)cn12,CCCCOC(C)=O,350.0
Cc1cc(-c2ccccc2)nc2c1ccc1nc(-c3ccccc3)cn12,CCOC(C)=O,352.0
Cc1cc(-c2ccccc2)nc2c1ccc1nc(-c3ccccc3)cn12,CO,345.0
Cc1cc(-c2ccccc2)nc2c1ccc1nc(-c3ccccc3)cn12,ClC(Cl)Cl,350.0
Cc1cc(-c2ccccc2)nc2c1ccc1nc(-c3ccccc3)cn12,ClCCl,348.0
Cc1cc(-c2ccccc2)nc2c1ccc1nc(-c3ccccc3)cn12,c1ccccc1,351.0
Cc1cc(-c2ccccc2C)cc(C)[o+]1,CC#N,327.0
Cc1cc(-c2ccccc2C)cc(C)[o+]1,ClCCl,343.0
Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c(C)cc1-c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1N2c1ccccc1,c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1,363.4351949
Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)cc(C)c1N1c2ccccc2CCc2ccccc21,Cc1ccccc1,392.7419355
Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1-c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1N2c1ccccc1,c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1,371.9178082
Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1-n1c2ccccc2c2cc3c(cc21)C1c2ccccc2C3c2ccccc21,Cc1ccccc1,364.0
Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1N1c2ccccc2C2(c3ccccc3-c3ccccc32)c2ccccc21,Cc1ccccc1,394.1941075
Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1N1c2ccccc2CCc2ccccc21,Cc1ccccc1,374.7311828
Cc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)ccc1N1c2ccccc2[Si](c2ccccc2)(c2ccccc2)c2ccccc21,Cc1ccccc1,379.0294627
Cc1cc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccc(C(C)(C)C)cc2)ccc1-c1ccc(-c2c(-c3ccccc3)nc3ccccn23)cc1,ClCCl,364.0
Cc1cc(-c2nnc(-c3c(C(C)C)cc(C(C)C)cc3C(C)C)o2)ccc1-n1c2ccccc2c2ccccc21,Cc1ccccc1,339.0
Cc1cc(-c2nnc(-c3ccccc3)o2)ccc1-n1c2ccccc2c2ccccc21,Cc1ccccc1,339.0
Cc1cc(-n2c3ccccc3c3cc(C#N)ccc32)ccc1-c1ccc(S(=O)(=O)c2ccccc2)cc1C,Cc1ccccc1,341.0
Cc1cc(-n2c3ccccc3c3cc4c(cc32)C2c3ccccc3C4c3ccccc32)c(C)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1,Cc1ccccc1,345.0
Cc1cc(-n2c3ccccc3c3cc4c(cc32)C2c3ccccc3C4c3ccccc32)ccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1,Cc1ccccc1,367.0
Cc1cc(-n2c3ccccc3c3ccccc32)ccc1-c1ccc(S(=O)(=O)c2ccccc2)cc1C,Cc1ccccc1,340.0
Cc1cc(/C=C(/C#N)C(=O)O)c(-c2cc3cc4c5c(c3oc2=O)C(C)(C)CCN5CCC4(C)C)s1,ClC(Cl)Cl,467.0
Cc1cc(/C=C(/C#N)C(=O)O)sc1/C=C/c1ccc(N(c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc2)cc1,CCO,463.0
Cc1cc(/C=C/C#Cc2ccccc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/C2=CCCCC2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,549.0
Cc1cc(/C=C/C=C(c2ccccc2)c2ccccc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,578.0
Cc1cc(/C=C/C=C/c2ccccc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,572.0
Cc1cc(/C=C/C=C/c2ccco2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,562.0
Cc1cc(/C=C/[C@@H](C)c2ccccc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,565.0
Cc1cc(/C=C/c2[nH]cnc2C)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,566.0
Cc1cc(/C=C/c2c(Br)ccc3c2OCO3)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,561.0
Cc1cc(/C=C/c2c(C)[nH]c3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,595.0
Cc1cc(/C=C/c2c(C)c(C)c(C)c(C)c2C)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,540.0
Cc1cc(/C=C/c2c(C)nn(C)c2C)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2c(F)ccc(F)c2Cl)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2c3ccccc3c(C)c3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,559.0
Cc1cc(/C=C/c2c3ccccc3cc3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,536.0
Cc1cc(/C=C/c2c[nH]c3ccc(Br)cc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,580.0
Cc1cc(/C=C/c2c[nH]c3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,584.0
Cc1cc(/C=C/c2cc(Br)cc(Br)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,557.0
Cc1cc(/C=C/c2cc(Br)cc3c2OCO3)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,565.0
Cc1cc(/C=C/c2cc(Br)ccc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,562.0
Cc1cc(/C=C/c2cc(Br)cs2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,567.0
Cc1cc(/C=C/c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,572.0
Cc1cc(/C=C/c2cc(C(C)(C)C)cc(C=O)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,560.0
Cc1cc(/C=C/c2cc(C(C)(C)C)ccc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2cc(C(F)(F)F)cc(Cl)c2F)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,557.0
Cc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc(C)c1Oc1ccccc1,CS(C)=O,559.0
Cc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)ccc1O,CS(C)=O,566.0
Cc1cc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)sc1C,CS(C)=O,577.0
Cc1cc(/C=C/c2cc(Cl)cc(Cl)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,560.0
Cc1cc(/C=C/c2cc(Cl)ccc2Cl)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,556.0
Cc1cc(/C=C/c2cc(Cl)ccc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,562.0
Cc1cc(/C=C/c2cc(F)ccc2F)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,559.0
Cc1cc(/C=C/c2cc(F)ccc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,562.0
Cc1cc(/C=C/c2cc(I)cc(I)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2cc(O)ccc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,569.0
Cc1cc(/C=C/c2cc(OC(F)(F)F)ccc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,560.0
Cc1cc(/C=C/c2cc(OCc3ccccc3)cc(OCc3ccccc3)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,557.0
Cc1cc(/C=C/c2cc([N+](=O)[O-])ccc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,560.0
Cc1cc(/C=C/c2cc3ccccc3c3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,565.0
Cc1cc(/C=C/c2cc3ccccc3nc2Cl)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,561.0
Cc1cc(/C=C/c2cc3ccccc3o2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,577.0
Cc1cc(/C=C/c2ccc(-c3ccc(Cl)cc3)o2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,594.0
Cc1cc(/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,600.0
Cc1cc(/C=C/c2ccc(-c3cccc(C(=O)O)c3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,565.0
Cc1cc(/C=C/c2ccc(-c3ccccc3)c(F)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,561.0
Cc1cc(/C=C/c2ccc(-c3ccccc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2ccc(-c3ccccc3)o2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,594.0
Cc1cc(/C=C/c2ccc(-c3ccccc3)s2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,589.0
Cc1cc(/C=C/c2ccc(-c3ccccn3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2ccc(-c3cccs3)s2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,596.0
Cc1cc(/C=C/c2ccc(-c3cncnc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,562.0
Cc1cc(/C=C/c2ccc(-n3ccnc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,561.0
Cc1cc(/C=C/c2ccc(/C=C/c3ccccc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2ccc(Br)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,556.0
Cc1cc(/C=C/c2ccc(Br)o2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,572.0
Cc1cc(/C=C/c2ccc(Br)s2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,572.0
Cc1cc(/C=C/c2ccc(C#N)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,561.0
Cc1cc(/C=C/c2ccc(C(=O)O)cc2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,567.0
Cc1cc(/C=C/c2ccc(C(C)C)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,557.0
Cc1cc(/C=C/c2ccc(C(F)(F)F)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,554.0
Cc1cc(/C=C/c2ccc(C(F)(F)F)cc2C(F)(F)F)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,578.0
Cc1cc(/C=C/c2ccc(C(F)(F)F)cc2F)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2ccc(C)c3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,567.0
Cc1cc(/C=C/c2ccc(C=O)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2ccc(C=O)s2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,580.0
Cc1cc(/C=C/c2ccc(CO)o2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,569.0
Cc1cc(/C=C/c2ccc(Cl)c(Cl)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,557.0
Cc1cc(/C=C/c2ccc(Cl)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,556.0
Cc1cc(/C=C/c2ccc(Cl)cc2Cl)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,558.0
Cc1cc(/C=C/c2ccc(F)c(Br)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,554.0
Cc1cc(/C=C/c2ccc(F)c(Oc3ccccc3)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,554.0
Cc1cc(/C=C/c2ccc(I)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,560.0
Cc1cc(/C=C/c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,584.0
Cc1cc(/C=C/c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,574.0
Cc1cc(/C=C/c2ccc(O)c(Br)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2ccc(O)c(O)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,584.0
Cc1cc(/C=C/c2ccc(O)c3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,586.0
Cc1cc(/C=C/c2ccc(O)cc2Cl)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,566.0
Cc1cc(/C=C/c2ccc(OC(=O)OC(C)(C)C)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,566.0
Cc1cc(/C=C/c2ccc(OC(F)(F)F)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2ccc(OC(F)F)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2ccc(OCCCN(C)C)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2ccc(OCc3ccc(Br)cc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2ccc(OCc3ccccc3)c(OCc3ccccc3)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,567.0
Cc1cc(/C=C/c2ccc(OCc3ccccc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2ccc(Oc3ccc(C=O)cc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,566.0
Cc1cc(/C=C/c2ccc(Oc3ccc(Cl)cc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,559.0
Cc1cc(/C=C/c2ccc(Oc3ccc(F)cc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,558.0
Cc1cc(/C=C/c2ccc(Oc3cccc(Cl)c3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,559.0
Cc1cc(/C=C/c2ccc(Oc3ccccc3)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,560.0
Cc1cc(/C=C/c2ccc(S(C)(=O)=O)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,567.0
Cc1cc(/C=C/c2ccc(SC(F)(F)F)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,556.0
Cc1cc(/C=C/c2ccc([N+](=O)[O-])c(O)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,562.0
Cc1cc(/C=C/c2ccc3c(c2)-c2ccccc2C3)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,571.0
Cc1cc(/C=C/c2ccc3c(c2)OC(F)(F)O3)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,558.0
Cc1cc(/C=C/c2ccc3c(c2)OCO3)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,566.0
Cc1cc(/C=C/c2ccc3c4c(cccc24)CC3)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,575.0
Cc1cc(/C=C/c2ccc3ccccc3n2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2ccc[nH]2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,586.0
Cc1cc(/C=C/c2cccc(Br)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,554.0
Cc1cc(/C=C/c2cccc(C#N)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2cccc(C(=O)O)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,553.0
Cc1cc(/C=C/c2cccc(C(C)(C)C)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2cccc(C=O)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,553.0
Cc1cc(/C=C/c2cccc(Cl)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,559.0
Cc1cc(/C=C/c2cccc(I)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2cccc(O)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,556.0
Cc1cc(/C=C/c2cccc(O)c2Cl)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,556.0
Cc1cc(/C=C/c2cccc(O)c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,563.0
Cc1cc(/C=C/c2cccc(Oc3ccc(C(C)(C)C)cc3)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2cccc(Oc3ccc(Cl)c(Cl)c3)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2cccc(Oc3ccccc3)c2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2cccc([N+](=O)[O-])c2O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,559.0
Cc1cc(/C=C/c2cccc3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2cccc3cccnc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,564.0
Cc1cc(/C=C/c2ccccc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,554.0
Cc1cc(/C=C/c2ccccc2-c2ccccc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,556.0
Cc1cc(/C=C/c2ccccc2B(O)O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2ccccc2Cl)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,555.0
Cc1cc(/C=C/c2ccccc2OC(F)(F)F)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,559.0
Cc1cc(/C=C/c2ccccc2OC(F)F)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,554.0
Cc1cc(/C=C/c2ccccc2OCC(=O)O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,561.0
Cc1cc(/C=C/c2ccccc2Oc2ccc(F)cc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,557.0
Cc1cc(/C=C/c2ccco2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,567.0
Cc1cc(/C=C/c2ccnc3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,560.0
Cc1cc(/C=C/c2ccoc2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,549.0
Cc1cc(/C=C/c2ccsc2C=O)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,572.0
Cc1cc(/C=C/c2cnc[nH]2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,557.0
Cc1cc(/C=C/c2csc3ccccc23)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,565.0
Cc1cc(/C=C/c2ncc[nH]2)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,567.0
Cc1cc(/C=C/c2nccn2C)n2c1C=C1C=CC=[N+]1[B-]2(F)F,CS(C)=O,569.0
Cc1cc(/N=C/c2cc(S(=O)(=O)O[Na])ccc2O)c(/N=C/c2cc(S(=O)(=O)O[Na])ccc2O)cc1C,O,371.0
Cc1cc(=O)[nH]c(=O)[nH]1,CC#N,256.0
Cc1cc(=O)c2c(ccc3ccc(O)cc32)o1,CC#N,336.0
Cc1cc(=O)c2ccc(O)cc2o1,O,333.0
Cc1cc(=O)cc(-c2ccc(-c3nc4ccccn4c3NC3CCCCC3)cc2)o1,ClCCl,357.0
Cc1cc(=O)oc2c(F)c(O)c(F)cc12,O,320.0
Cc1cc(=O)oc2c1cc(Br)c1occ(C)c12,C1CCCCC1,333.0
Cc1cc(=O)oc2c1cc(Br)c1occ(C)c12,CCO,330.0
Cc1cc(=O)oc2c1cc(Cl)c1occ(C)c12,C1CCCCC1,332.0
Cc1cc(=O)oc2c1cc(Cl)c1occ(C)c12,CCO,333.0
Cc1cc(=O)oc2c1cc(O)c1ccccc12,CCO,380.0
Cc1cc(=O)oc2c3c4c(cc12)C(C)(C)CCN4CCC3(C)C,ClCCl,382.0
Cc1cc(=O)oc2c3c4c(cc12)CCCN4CCC3,C1CCCCC1,361.0
Cc1cc(=O)oc2c3c4c(cc12)CCCN4CCC3,CC#N,380.0
Cc1cc(=O)oc2c3c4c(cc12)CCCN4CCC3,CCO,387.0
Cc1cc(=O)oc2c3c4c(cc12)CCCN4CCC3,O,396.0
Cc1cc(=O)oc2cc(-c3cn(Cc4ccccc4)nn3)ccc12,CCO,329.0
Cc1cc(=O)oc2cc(/[NH+]=C/C=C3/C=C(C(=O)O)NC(C(=O)O)C3)ccc12,O,520.0
Cc1cc(=O)oc2cc(N)ccc12,CO,351.0
Cc1cc(=O)oc2cc(N)ccc12,ClCCl,336.0
Cc1cc(=O)oc2cc(N)ccc12,O,360.0
Cc1cc(=O)oc2cc(Oc3ccc4c(c3)-c3nc-4nc4[nH]c(nc5nc(nc6[nH]c(n3)c3ccc(Oc7ccc8c(C)cc(=O)oc8c7)cc63)-c3cc(Oc6ccc7c(C)cc(=O)oc7c6)ccc3-5)c3cc(Oc5ccc6c(C)cc(=O)oc6c5)ccc43)ccc12,CN(C)C=O,660.0
Cc1cc(=O)oc2cc(Oc3ccc4c(c3)-c3nc-4nc4[nH]c(nc5nc(nc6[nH]c(n3)c3ccc(Oc7ccc8c(C)cc(=O)oc8c7)cc63)-c3cc(Oc6ccc7c(C)cc(=O)oc7c6)ccc3-5)c3cc(Oc5ccc6c(C)cc(=O)oc6c5)ccc43)ccc12,ClCCl,660.0
Cc1cc(=O)oc2cc3[nH]c(-c4ccccc4)nc3cc12,CC(C)O,346.0
Cc1cc(=O)oc2cc3[nH]c(C=Cc4ccccc4)nc3cc12,CO,374.0
Cc1cc(=O)oc2cc3c(cc12)C(C)CC(C)(C)N3CCCC(=O)O,O,390.0
Cc1cc(=O)oc2cc3c4ccccc4c4ccccc4c3cc12,C1CCOC1,378.0
Cc1cc(=O)oc2cc3c4ccccc4c4ccccc4c3cc12,CC#N,375.0
Cc1cc(=O)oc2cc3c4ccccc4c4ccccc4c3cc12,CO,377.0
Cc1cc(=O)oc2cc3c4ccccc4c4ccccc4c3cc12,CS(C)=O,378.0
Cc1cc(=O)oc2cc3c4ccccc4c4ccccc4c3cc12,Cc1ccccc1,381.0
Cc1cc(=O)oc2cc3c4ccccc4c4ccccc4c3cc12,ClC(Cl)Cl,362.0
Cc1cc(=O)oc2cc3cc(-c4cn(Cc5ccccc5)nn4)ccc3cc12,CCO,339.0
Cc1cc(=O)oc2cc3cc(O)ccc3cc12,CC#N,343.0
Cc1cc(=O)oc2cc3cc(O)ccc3cc12,CCO,357.0
Cc1cc(=O)oc2ccc3ccc(-c4cn(Cc5ccccc5)nn4)cc3c12,CCO,352.0
Cc1cc(=O)oc2ccc3ccc(O)cc3c12,CC#N,347.0
Cc1cc(=O)oc2ccc3ccc(O)cc3c12,CCO,350.0
Cc1cc(Br)cn(Cn2cccc(C)c2=O)c1=N,CC(=O)O,310.0
Cc1cc(C#Cc2ccccc2)c2ccc3c(C#Cc4ccccc4)cc(C#Cc4ccccc4)c4ccc1c2c43,CS(C)=O,451.0
Cc1cc(C#Cc2ccccc2)c2ccc3c(C#Cc4ccccc4)cc(C#Cc4ccccc4)c4ccc1c2c43,ClC(Cl)(Cl)Cl,445.0
Cc1cc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)ccc1F,CS(C)=O,430.0
Cc1cc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)no1,CS(C)=O,431.0
Cc1cc(C(C)(C)C)c(OC2=C(C=CC3=C(C#N)C(=C(C#N)C#N)OC3(C)C)CC(C(C)(C)C)CC2=CC=C2N(C)c3ccccc3C2(C)C)c(C(C)(C)C)c1,CN(C)C=O,896.0
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,CC#N,362.6
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,CCCCCC,376.5
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,CCCCOC(C)=O,368.6
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,CCOC(C)=O,368.2
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,CO,359.6
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,Cc1ccccc1,375.2
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,ClC(Cl)Cl,369.2
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,ClCCl,366.6
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(Cl)cc3)cn12,c1ccccc1,375.0
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,CC#N,359.5
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,CCCCCC,372.0
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,CCCCOC(C)=O,365.0
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,CCOC(C)=O,364.5
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,CO,356.0
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,Cc1ccccc1,371.5
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,ClC(Cl)Cl,364.5
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,ClCCl,363.5
Cc1cc(C(F)(F)F)nc2c1ccc1nc(-c3ccc(F)c(F)c3)cn12,c1ccccc1,371.0
Cc1cc(C)c(-c2c3ccccc3c3ccc4cc5c(-c6c(C)cc(C)cc6C)c6ccccc6c6ccc7cc2c3c4c7c56)c(C)c1,ClCCl,607.0
Cc1cc(C)c(-c2cc(-c3c(C)cc(C)cc3C)c3ccc4c(-c5c(C)cc(C)cc5C)cc(-c5c(C)cc(C)cc5C)c5ccc2c3c54)c(C)c1,ClCCl,363.0
Cc1cc(C)c(-c2cc3c(s2)-c2sc(-c4c(C)cc(C)cc4C)cc2P(c2ccccc2)(c2ccccc2)=[O+][B-]3(c2c(C)cc(C)cc2C)c2c(C)cc(C)cc2C)c(C)c1,C1CCOC1,366.0
Cc1cc(C)c(-c2nnc(-c3ccc(-n4c5ccccc5c5ccccc54)c(C)c3)o2)c(C)c1,Cc1ccccc1,339.0
Cc1cc(C)c(-c2nnc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)o2)c(C)c1,Cc1ccccc1,340.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(C#Cc3c(F)c(F)c(C(=O)O)c(F)c3F)=c3/cc/c4n3[Zn]n3c2ccc3/C(N(c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c(C)c1,ClCCl,641.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(C#Cc3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(N(c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c(C)c1,ClCCl,634.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3c(C)cc(C)cc3C)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(-c3ccc(C(=O)O)cc3)cc2)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c(C)c1,ClCCl,585.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3c(C)cc(C)cc3C)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(/C=C/c3sc(/C=C/c5sc(/C=C(\C#N)C(=O)O)c6c5OCCO6)c5c3OCCO5)cc2)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c(C)c1,ClCCl,595.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3c(C)cc(C)cc3C)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c(C)c1,ClCCl,586.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3c(C)cc(C)cc3C)=c3/cc/c4n3[Zn]n3c2c2cc5ncc(C(=O)O)nc5cc2c3/C(c2c(C)cc(C)cc2C)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c(C)c1,ClCCl,622.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3c(C)cc(C)cc3C)=c3/cc/c4n3[Zn]n3c2cc2c5cccc6c(C(=O)O)ccc(/c(c23)=C2\C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c65)c(C)c1,ClCCl,682.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3c(C)cc(C)cc3C)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2c(C)cc(C)cc2C)=C2\N=C(/C=4c3c(C)cc(C)cc3C)c3nc4ccc(C(=O)O)cc4nc32)c(C)c1,CO,621.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3c(C)cc(C)cc3C)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2c(C)cc(C)cc2C)=C2\N=C(C=C2/C=C(/C#N)C(=O)O)/C=4c2ccc(C(C)(C)C)cc2)c(C)c1,ClCCl,612.0
Cc1cc(C)c(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2c(C)cc(C)cc2C)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c(C)c1,ClCCl,592.0
Cc1cc(C)c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(C)c1,CS(C)=O,559.0
Cc1cc(C)c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1C,CS(C)=O,558.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2c(C)cc(-n3c4ccccc4c4cc(N(c5ccccc5)c5ccccc5)ccc43)cc2C)c(C)c1,Cc1ccccc1,375.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3cc(N(C)C)c4ccccc4c3c3c2ccc2ccccc23)c(C)c1,C1CCCCC1,430.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3cc(N(C)C)c4ccccc4c3c3c2ccc2ccccc23)c(C)c1,C1CCOC1,431.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3cc(N(C)C)c4ccccc4c3c3c2ccc2ccccc23)c(C)c1,CC#N,429.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3cc(N(C)C)c4ccccc4c3c3c2ccc2ccccc23)c(C)c1,ClC(Cl)Cl,431.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3cc(N(C)C)c4ccccc4c3c3c2ccc2ccccc23)c(C)c1,c1ccccc1,433.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2cc(N(C)C)c2ccccc23)c(C)c1,C1CCCCC1,438.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2cc(N(C)C)c2ccccc23)c(C)c1,C1CCOC1,439.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2cc(N(C)C)c2ccccc23)c(C)c1,CC#N,437.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2cc(N(C)C)c2ccccc23)c(C)c1,ClC(Cl)Cl,440.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2cc(N(C)C)c2ccccc23)c(C)c1,c1ccccc1,440.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2ccc2ccccc23)c(C)c1,C1CCCCC1,413.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2ccc2ccccc23)c(C)c1,C1CCOC1,413.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2ccc2ccccc23)c(C)c1,CC#N,410.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2ccc2ccccc23)c(C)c1,ClC(Cl)Cl,413.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3ccc4ccccc4c3c3c2ccc2ccccc23)c(C)c1,c1ccccc1,415.0
Cc1cc(C)c(B(c2c(C)cc(C)cc2C)c2cc3cccc4c(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5cccc2c5c34)c(C)c1,CCCCCC,392.0
Cc1cc(C)c(B(c2cc(-c3c(C)cc(C)cc3C)sc2-c2sc(-c3c(C)cc(C)cc3C)cc2P(=O)(c2ccccc2)c2ccccc2)c2c(C)cc(C)cc2C)c(C)c1,CO,370.0
Cc1cc(C)c(B(c2cc(-c3ccc(C(F)(F)F)cc3)sc2-c2sc(-c3ccc(C(F)(F)F)cc3)cc2P(=O)(c2ccccc2)c2ccccc2)c2c(C)cc(C)cc2C)c(C)c1,CO,389.0
Cc1cc(C)c(B(c2cc(-c3ccc(N(C)C)cc3)sc2-c2sc(-c3ccc(N(C)C)cc3)cc2P(=O)(c2ccccc2)c2ccccc2)c2c(C)cc(C)cc2C)c(C)c1,CO,435.0
Cc1cc(C)c(B(c2cc(-c3ccccc3)sc2-c2sc(-c3ccccc3)cc2P(=O)(c2ccccc2)c2ccccc2)c2c(C)cc(C)cc2C)c(C)c1,CO,392.0
Cc1cc(C)c(B(c2cc(C#Cc3ccccc3)sc2-c2sc(C#Cc3ccccc3)cc2P(=O)(c2ccccc2)c2ccccc2)c2c(C)cc(C)cc2C)c(C)c1,CO,400.0
Cc1cc(C)c(B(c2cc3c4c(c(B(c5c(C)cc(C)cc5C)c5c(C)cc(C)cc5C)cc5c4c2CCC5)CCC3)c2c(C)cc(C)cc2C)c(C)c1,CCCCCC,420.0
Cc1cc(C)c(B(c2cc3ccc4cccc5ccc(c2)c3c45)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,413.0
Cc1cc(C)c(B(c2ccc(-c3cc4ccc5cccc6ccc(c3)c4c56)cc2)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,378.0
Cc1cc(C)c(B(c2ccc(-c3cc4ccccc4n3C)s2)c2c(C)cc(C)cc2C)c(C)c1,C1CCCCC1,395.0
Cc1cc(C)c(B(c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)cc2)c2c(C)cc(C)cc2C)c(C)c1,C1CCOC1,375.0
Cc1cc(C)c(B(c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)cc2)c2c(C)cc(C)cc2C)c(C)c1,CC(C)=O,373.0
Cc1cc(C)c(B(c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)cc2)c2c(C)cc(C)cc2C)c(C)c1,CS(C)=O,378.0
Cc1cc(C)c(B(c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)cc2)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,374.0
Cc1cc(C)c(B(c2ccc(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)cc2)c2c(C)cc(C)cc2C)c(C)c1,ClCCl,371.0
Cc1cc(C)c(B(c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)c2c(C)cc(C)cc2C)c(C)c1,C1CCOC1,384.0
Cc1cc(C)c(B(c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)c2c(C)cc(C)cc2C)c(C)c1,CC(C)=O,380.0
Cc1cc(C)c(B(c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)c2c(C)cc(C)cc2C)c(C)c1,CS(C)=O,386.0
Cc1cc(C)c(B(c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,381.0
Cc1cc(C)c(B(c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)c2c(C)cc(C)cc2C)c(C)c1,ClCCl,376.0
Cc1cc(C)c(B(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,360.0
Cc1cc(C)c(B(c2ccc(B3N(C(C)(C)C)C=CN3C(C)(C)C)s2)c2c(C)cc(C)cc2C)c(C)c1,C1CCCCC1,331.0
Cc1cc(C)c(B(c2ccc(B3N(C(C)(C)C)CCN3C(C)(C)C)s2)c2c(C)cc(C)cc2C)c(C)c1,C1CCCCC1,331.0
Cc1cc(C)c(B(c2ccc(B3Oc4ccccc4O3)s2)c2c(C)cc(C)cc2C)c(C)c1,C1CCCCC1,335.0
Cc1cc(C)c(B(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,380.0
Cc1cc(C)c(B(c2ccccc2-n2c3ccccc3c3ccccc32)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,387.0
Cc1cc(C)c(B(c2ccccc2N2c3ccccc3Oc3ccccc32)c2c(C)cc(C)cc2C)c(C)c1,Cc1ccccc1,445.0
Cc1cc(C)c(B(c2ccsc2-c2sccc2P(=O)(c2ccccc2)c2ccccc2)c2c(C)cc(C)cc2C)c(C)c1,CO,350.0
Cc1cc(C)c(B2N(c3c(C(C)C)cccc3C(C)C)C(c3ccccc3)=C(c3ccccc3)N2c2c(C(C)C)cccc2C(C)C)c(C)c1,C1CCOC1,411.0
Cc1cc(C)c(B2Nc3cccc4c3-n3c2ccc3B(c2c(C)cc(C)cc2C)N4)c(C)c1,ClCCl,318.0
Cc1cc(C)c(B2c3cc(C(C)(C)C)cc4c5ccccc5c5c6ccccc6c6cc(C(C)(C)C)cc2c6c5c34)c(C)c1,C1CCCCC1,429.0
Cc1cc(C)c(B2c3cc(C(C)(C)C)cc4ccc5c6ccccc6c6cc(C(C)(C)C)cc2c6c5c34)c(C)c1,C1CCCCC1,424.0
Cc1cc(C)c(B2c3cc(C(C)(C)C)cc4ccc5ccc6cc(C(C)(C)C)cc2c6c5c34)c(C)c1,C1CCCCC1,427.0
Cc1cc(C)c(B2c3cc(C(C)(C)C)ccc3-c3c(-c4ccccc4)ccc4cc(C(C)(C)C)cc2c34)c(C)c1,C1CCCCC1,406.0
Cc1cc(C)c(B2c3cc(C(C)(C)C)ccc3-c3cccc4cc(C(C)(C)C)cc2c34)c(C)c1,C1CCCCC1,409.0
Cc1cc(C)c(B2c3cc(C)ccc3N3c4ccc(C)cc4B(c4c(C)cc(C)cc4C)c4cc(C)cc2c43)c(C)c1,ClCCl,457.0
Cc1cc(C)c(C)c(-c2cc(-c3c(C)c(C)cc(C)c3C)c3ccc4c(-c5c(C)c(C)cc(C)c5C)cc(-c5c(C)c(C)cc(C)c5C)c5ccc2c3c54)c1C,ClCCl,364.0
Cc1cc(C)c(C)c(-c2ccc3cc(C)c(=O)oc3c2)c1C,C1CCCCC1,312.0
Cc1cc(C)c(C)c(-c2ccc3cc(C)c(=O)oc3c2)c1C,CC#N,314.0
Cc1cc(C)c(C)c(-c2ccc3cc(C)c(=O)oc3c2)c1C,CO,315.0
Cc1cc(C)c(C)c(B(c2c(C)c(C)c(N3c4ccccc4Oc4ccccc43)c(C)c2C)c2c(C)c(C)c(N3c4ccccc4Oc4ccccc43)c(C)c2C)c1C,CC(C)(C)c1ccc(-n2c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1,387.0
Cc1cc(C)c(C)c(B(c2c(C)c(C)cc(C)c2C)c2c(C)c(C)c(N3c4ccccc4Oc4ccccc43)c(C)c2C)c1C,CC(C)(C)c1ccc(-n2c3ccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)cc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc32)cc1,373.0
Cc1cc(C)c(C2=C3C=C(/C=C/C(=O)OC(C)(C)C)C=[N+]3[B-](F)(F)n3cc(/C=C/C(=O)OC(C)(C)C)cc32)c(C)c1,ClCCl,580.0
Cc1cc(C)c(C2=C3C=C(/C=C/C(=O)OC(C)(C)C)C=[N+]3[B-](F)(F)n3cccc32)c(C)c1,ClCCl,538.0
Cc1cc(C)c(C2=C3C=C(/C=C/C(=O)OCc4ccccc4)C=[N+]3[B-](F)(F)n3cc(/C=C/C(=O)OCc4ccccc4)cc32)c(C)c1,ClCCl,576.0
Cc1cc(C)c(C2=C3C=C(/C=C/C(=O)OCc4ccccc4)C=[N+]3[B-](F)(F)n3cccc32)c(C)c1,ClCCl,537.0
Cc1cc(C)c(C2=C3C=C(C(OC(=O)c4ccccc4)C(=O)NC(C)(C)C)C=[N+]3[B-](F)(F)n3cccc32)c(C)c1,CCOC(C)=O,505.5
Cc1cc(C)c(C2=C3C=C(c4ccc(C(C)(C)C)cc4)C(c4ccc(C(C)(C)C)cc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccc(C(C)(C)C)cc2)c3-c2ccc(C(C)(C)C)cc2)c(C)c1,C1CCCCC1,602.0
Cc1cc(C)c(C2=C3C=C(c4ccc(C(C)(C)C)cc4)C(c4ccc(C(C)(C)C)cc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccc(C(C)(C)C)cc2)c3-c2ccc(C(C)(C)C)cc2)c(C)c1,C1CCOC1,602.0
Cc1cc(C)c(C2=C3C=C(c4ccc(C(C)(C)C)cc4)C(c4ccc(C(C)(C)C)cc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccc(C(C)(C)C)cc2)c3-c2ccc(C(C)(C)C)cc2)c(C)c1,CC#N,592.0
Cc1cc(C)c(C2=C3C=C(c4ccc(C(C)(C)C)cc4)C(c4ccc(C(C)(C)C)cc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccc(C(C)(C)C)cc2)c3-c2ccc(C(C)(C)C)cc2)c(C)c1,Cc1ccccc1,606.0
Cc1cc(C)c(C2=C3C=C(c4ccc(C(C)(C)C)cc4)C(c4ccc(C(C)(C)C)cc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccc(C(C)(C)C)cc2)c3-c2ccc(C(C)(C)C)cc2)c(C)c1,ClCCl,599.0
Cc1cc(C)c(C2=C3C=C(c4ccccc4)C(c4ccccc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccccc2)c3-c2ccccc2)c(C)c1,C1CCCCC1,590.0
Cc1cc(C)c(C2=C3C=C(c4ccccc4)C(c4ccccc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccccc2)c3-c2ccccc2)c(C)c1,C1CCOC1,587.0
Cc1cc(C)c(C2=C3C=C(c4ccccc4)C(c4ccccc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccccc2)c3-c2ccccc2)c(C)c1,CC#N,578.0
Cc1cc(C)c(C2=C3C=C(c4ccccc4)C(c4ccccc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccccc2)c3-c2ccccc2)c(C)c1,Cc1ccccc1,592.0
Cc1cc(C)c(C2=C3C=C(c4ccccc4)C(c4ccccc4)=[N+]3[B-](F)(F)n3c2cc(-c2ccccc2)c3-c2ccccc2)c(C)c1,ClCCl,585.0
Cc1cc(C)c(C2=C3C=CC(c4ccc5c(ccc6ccccc65)c4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccc3c(ccc4ccccc43)c2)c(C)c1,ClC(Cl)Cl,579.0
Cc1cc(C)c(C2=C3C=CC(c4cccc5ccccc45)=[N+]3[B-](F)(F)n3c2ccc3-c2cccc3ccccc23)c(C)c1,ClC(Cl)Cl,538.0
Cc1cc(C)c(C2=C3C=CC(c4ccccc4O)=[N+]3[B-]3(c4ccccc4)Oc4ccccc4-c4ccc2n43)c(C)c1,ClC(Cl)Cl,588.0
Cc1cc(C)c(C2=C3C=CC(c4csc5ccccc45)=[N+]3[B-](F)(F)n3c2ccc3-c2csc3ccccc23)c(C)c1,ClC(Cl)Cl,581.0
Cc1cc(C)c(C2=C3C=CC4=[N+]3[B-]3(Oc5ccccc54)Oc4ccccc4-c4ccc2n43)c(C)c1,ClC(Cl)Cl,626.0
Cc1cc(C)c(C2=C3C=CC=[N+]3[B-]3(c4cccc5ccccc45)Oc4cc(O)cc5c6ccc(C)cc6c6cc2n3c6c45)c(C)c1,ClC(Cl)Cl,646.0
Cc1cc(C)c(C2=C3C=CC=[N+]3[B-]3(c4ccccc4)Oc4cc(O)cc5c6ccc(C)cc6c6cc2n3c6c45)c(C)c1,ClC(Cl)Cl,643.0
Cc1cc(C)c(C2=C3C=c4c(c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc4c23)c(C)c1,C1CCCCC1,693.0
Cc1cc(C)c(C2=C3C=c4c(c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc4c23)c(C)c1,C1CCOC1,692.0
Cc1cc(C)c(C2=C3C=c4c(c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc4c23)c(C)c1,CC#N,686.0
Cc1cc(C)c(C2=C3C=c4c(c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc4c23)c(C)c1,Cc1ccccc1,698.0
Cc1cc(C)c(C2=C3C=c4c(c5ccc(C(C)(C)C)cc5c5cc(C(C)(C)C)ccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccc(C(C)(C)C)cc4c4cc(C(C)(C)C)ccc4c23)c(C)c1,ClCCl,693.0
Cc1cc(C)c(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,C1CCOC1,609.0
Cc1cc(C)c(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CC#N,601.0
Cc1cc(C)c(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CCCCCC,610.0
Cc1cc(C)c(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CO,603.0
Cc1cc(C)c(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,Cc1ccccc1,616.0
Cc1cc(C)c(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,ClCCl,609.0
Cc1cc(C)c(N(c2ccccc2)c2ccc(S(=O)(=O)c3ccc(S(=O)(=O)c4ccc(N(c5ccccc5)c5c(C)cc(C)cc5C)cc4)cc3)cc2)c(C)c1,Cc1ccccc1,351.0
Cc1cc(C)c(N2B(c3ccccc3)N(c3c(C)cc(C)cc3C)C(c3ccccc3)=C2c2ccccc2)c(C)c1,C1CCOC1,388.0
Cc1cc(C)c(N=Cc2cc(C)cc(C(c3ccccc3)c3ccccc3)c2O)c(C)c1,Cc1ccccc1,349.0
Cc1cc(C)c(OP2(=O)c3cccc4cccc(c34)-c3cccc4cccc2c34)c(C)c1,ClCCl,351.0
Cc1cc(C)c(Oc2cccc3c(/C4=c5\cc/c6n5[Zn]n5c(ccc5/C(c5cc(C(C)(C)C)cc(C(C)(C)C)c5)=C5/C=CC4=N5)/C(C#Cc4ccc(C(=O)O)cc4)=C4/C=CC(=N4)/C=6c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4cccc(Oc5c(C)cc(C)cc5C)c4cc23)c(C)c1,C1CCOC1,639.0
Cc1cc(C)c([B-]2(c3c(C)cc(C)cc3C)[O+]=P(c3ccccc3)(c3ccccc3)c3cc(-c4ccc(C(C)(C)C)cc4)sc3-c3sc(-c4ccc(C(C)(C)C)cc4)cc32)c(C)c1,C1CCOC1,409.0
Cc1cc(C)c([B-]2(c3c(C)cc(C)cc3C)[O+]=P(c3ccccc3)(c3ccccc3)c3cc(-c4ccc(C(F)(F)F)cc4)sc3-c3sc(-c4ccc(C(F)(F)F)cc4)cc32)c(C)c1,C1CCOC1,405.0
Cc1cc(C)c([B-]2(c3c(C)cc(C)cc3C)[O+]=P(c3ccccc3)(c3ccccc3)c3cc(-c4ccc(N(C)C)cc4)sc3-c3sc(-c4ccc(N(C)C)cc4)cc32)c(C)c1,C1CCOC1,445.0
Cc1cc(C)c([B-]2(c3c(C)cc(C)cc3C)[O+]=P(c3ccccc3)(c3ccccc3)c3cc(-c4ccccc4)sc3-c3sc(-c4ccccc4)cc32)c(C)c1,C1CCOC1,402.0
Cc1cc(C)c([B-]2(c3c(C)cc(C)cc3C)[O+]=P(c3ccccc3)(c3ccccc3)c3cc(C#Cc4ccccc4)sc3-c3sc(C#Cc4ccccc4)cc32)c(C)c1,C1CCOC1,417.0
Cc1cc(C)c([O-])c(C=Nc2cccc3ccc(-c4nc5ccccc5[nH]4)nc23)c1,Cc1ccccc1,323.0
Cc1cc(C)c2c(c1)c1cc(C)cc(C)c1n2-c1ccc2c(c1)Oc1ccccc1B2c1c(C(C)C)cc(C(C)C)cc1C(C)C,Cc1ccccc1,418.0
Cc1cc(C)c2c(c1)nc1c(=O)n(C)c(=O)nc-1n2C,CC#N,448.0
Cc1cc(C)c2cc3cc(C)ncc3cc2c1,CCO,386.1003861
Cc1cc(C)c2ccc(NC(=O)CCl)nc2n1,CC#N,328.0
Cc1cc(C)c2nc3c(=O)n(C)c(=O)nc-3n(C)c2c1,CC#N,446.0
Cc1cc(C)cc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(C)C)ccc23)c1,O,525.0
Cc1cc(C)cc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)c1,O,530.0
Cc1cc(C)cc(-c2ccc(C(C#N)=Cc3ccc(-c4csc(C=C(C#N)c5ccccc5)c4)cc3)cc2)c1,C1CCOC1,370.0
Cc1cc(C)cc(-c2ccc(C(C#N)=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c1,C1CCCCC1,413.0
Cc1cc(C)cc(/C2=C3\C=CC(=N3)/C(c3cc(C)cc(C)c3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cc(C)cc(C)c2)=C2/C=C(/C=C/C=C(C(=O)O)C(=O)O)C(=N2)/C=4c2cc(C)cc(C)c2)c1,CN(C)C=O,610.0
Cc1cc(C)cc(C)c1,C1CCCCC1,261.5746796
Cc1cc(C)cc(C)c1,CCCCCC,294.0
Cc1cc(C)cc(N2C(=O)c3cccc4cc(N=Cc5ccc(-c6ccc(C=Nc7cc8c9c(cccc9c7)C(=O)N(c7cc(C)cc(C)c7)C8=O)s6)s5)cc(c34)C2=O)c1,ClC(Cl)Cl,425.0
Cc1cc(C)cc(N2C(=O)c3cccc4cc(N=Cc5ccc(-c6cccs6)s5)cc(c34)C2=O)c1,ClC(Cl)Cl,375.0
Cc1cc(C)cc(N2C(=O)c3cccc4cc(N=Cc5ccc(C=Nc6cc7c8c(cccc8c6)C(=O)N(c6cc(C)cc(C)c6)C7=O)s5)cc(c34)C2=O)c1,ClC(Cl)Cl,388.0
Cc1cc(C)cc(N2C(=O)c3cccc4cc(N=Cc5cccs5)cc(c34)C2=O)c1,ClC(Cl)Cl,408.0
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,C1CCOC1,293.4
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,CC#N,285.0
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,CCCCCC,280.5
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,CCOC(C)=O,282.5
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,CN(C)C=O,285.3
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,CO,271.5
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,CS(C)=O,283.1
Cc1cc(C)cc(NC(=O)c2sc(Br)nc2C)c1,ClC(Cl)Cl,278.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3[nH]c4ccccc4c3C)=[N+]1[B-]2(F)F,C1CCOC1,604.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3[nH]c4ccccc4c3C)=[N+]1[B-]2(F)F,CC#N,596.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3[nH]c4ccccc4c3C)=[N+]1[B-]2(F)F,CCCCCC,610.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3[nH]c4ccccc4c3C)=[N+]1[B-]2(F)F,CO,598.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3[nH]c4ccccc4c3C)=[N+]1[B-]2(F)F,Cc1ccccc1,615.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3[nH]c4ccccc4c3C)=[N+]1[B-]2(F)F,ClCCl,608.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3c[nH]c4ccccc34)=[N+]1[B-]2(F)F,C1CCOC1,583.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3c[nH]c4ccccc34)=[N+]1[B-]2(F)F,CC#N,575.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3c[nH]c4ccccc34)=[N+]1[B-]2(F)F,CCCCCC,580.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3c[nH]c4ccccc34)=[N+]1[B-]2(F)F,CO,579.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3c[nH]c4ccccc34)=[N+]1[B-]2(F)F,Cc1ccccc1,587.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3c[nH]c4ccccc34)=[N+]1[B-]2(F)F,ClCCl,581.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3ccc[nH]3)=[N+]1[B-]2(F)F,C1CCOC1,599.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3ccc[nH]3)=[N+]1[B-]2(F)F,CC#N,594.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3ccc[nH]3)=[N+]1[B-]2(F)F,CCCCCC,601.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3ccc[nH]3)=[N+]1[B-]2(F)F,CO,595.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3ccc[nH]3)=[N+]1[B-]2(F)F,Cc1ccccc1,606.0
Cc1cc(C)n2c1C=C1c3ccccc3C(c3ccc[nH]3)=[N+]1[B-]2(F)F,ClCCl,602.0
Cc1cc(C)n2c1C=[N+]1[N+](=C3C=NC=CN3[B-]1(F)F)[B-]2(F)F,ClCCl,467.0
Cc1cc(C)nc(N)n1,CCO,297.0
Cc1cc(C)nc(N)n1,CO,296.0
Cc1cc(C)nc(N)n1,O,284.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,C1CCOC1,396.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,C1COCCO1,396.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CC#N,398.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CC(C)(C)O,411.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CC(C)=O,394.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CC(C)O,413.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CCCCCO,417.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CCCO,415.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CCO,414.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CCOC(C)=O,395.0
Cc1cc(C2(c3cc(C)c(O)c(Br)c3)OS(=O)(=O)c3ccccc32)cc(Br)c1O,CCOCC,395.0
Cc1cc(C2=C(c3cc(C)sc3C)P(=O)(c3ccccc3)c3ccccc32)c(C)s1,C1CCOC1,355.0
Cc1cc(C2=C(c3cc(C)sc3C)S(=O)(=O)c3ccccc32)c(C)s1,C1CCOC1,349.0
Cc1cc(C=C(C#N)C(=O)O)sc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,466.0
Cc1cc(C=Nc2c(C(C)C)cccc2C(C)C)c(O)c(C(c2ccccc2)c2ccccc2)c1,Cc1ccccc1,346.0
Cc1cc(C=O)cc(C)c1-c1ccc(N(C)C)cc1,CC1CCCO1,338.0
Cc1cc(C=O)cc(C)c1-c1ccc(N(C)C)cc1,CCCCCC,338.0
Cc1cc(C=O)cc(C)c1-c1ccc(N(C)C)cc1,CCOC(C)=O,338.0
Cc1cc(C=O)cc(C)c1-c1ccc(N(C)C)cc1,CCOCC,338.0
Cc1cc(C=O)cc(C)c1-c1ccc(N(C)C)cc1,Cc1ccccc1,338.0
Cc1cc(C=O)cc(C)c1-c1ccc(N(C)C)cc1,ClC(Cl)Cl,338.0
Cc1cc(C=O)cc(C)c1-c1ccc(N(C)C)cc1,ClCCl,338.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1,C1CCOC1,350.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1,CC#N,350.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1,CCCCCC,350.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1,CN(C)C=O,350.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1,CO,350.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1,Cc1ccccc1,350.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1,ClCCl,350.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1C,CC1CCCO1,339.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1C,CCCCCC,339.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1C,CCOC(C)=O,339.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1C,CCOCC,339.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1C,Cc1ccccc1,339.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1C,ClC(Cl)Cl,339.0
Cc1cc(C=O)ccc1-c1ccc(N(C)C)cc1C,ClCCl,339.0
Cc1cc(N(C)C)cc(C)c1-c1ccc(C=O)cc1,CC1CCCO1,344.0
Cc1cc(N(C)C)cc(C)c1-c1ccc(C=O)cc1,CCCCCC,344.0
Cc1cc(N(C)C)cc(C)c1-c1ccc(C=O)cc1,CCOC(C)=O,344.0
Cc1cc(N(C)C)cc(C)c1-c1ccc(C=O)cc1,CCOCC,344.0
Cc1cc(N(C)C)cc(C)c1-c1ccc(C=O)cc1,Cc1ccccc1,344.0
Cc1cc(N(C)C)cc(C)c1-c1ccc(C=O)cc1,ClC(Cl)Cl,344.0
Cc1cc(N(C)C)cc(C)c1-c1ccc(C=O)cc1,ClCCl,344.0
Cc1cc(N(C)C)cc(C)c1/C=C/C=C/c1ccc(C#N)cc1,CC#N,392.0
Cc1cc(N(C)C)cc(C)c1/C=C/C=C/c1ccc(C#N)cc1,CCCCCC,390.0
Cc1cc(N(C)C)cc(C)c1/C=C/C=C/c1ccc(C#N)cc1,CCOCC,388.0
Cc1cc(N(C)C)ccc1-c1ccc(C=O)cc1,C1CCOC1,356.0
Cc1cc(N(C)C)ccc1-c1ccc(C=O)cc1,CC#N,356.0
Cc1cc(N(C)C)ccc1-c1ccc(C=O)cc1,CCCCCC,356.0
Cc1cc(N(C)C)ccc1-c1ccc(C=O)cc1,CN(C)C=O,356.0
Cc1cc(N(C)C)ccc1-c1ccc(C=O)cc1,CO,356.0
Cc1cc(N(C)C)ccc1-c1ccc(C=O)cc1,Cc1ccccc1,356.0
Cc1cc(N(C)C)ccc1-c1ccc(C=O)cc1,ClCCl,356.0
Cc1cc(N(C)C)ccc1C1=C2C=CC(=[N+](C)C)C=C2[Si](C)(C)c2cc(N(C)C)ccc21,O,646.0
Cc1cc(N)no1,CS(C)=O,310.0
Cc1cc(N2c3ccccc3C(C)(C)c3ccccc32)ccc1-c1cc(-c2ccc(N3c4ccccc4C(C)(C)c4ccccc43)cc2C)ncn1,Cc1ccccc1,375.9375
Cc1cc(N2c3ccccc3C3(c4ccccc4-c4ccccc43)c3ccccc32)c(C)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1,Cc1ccccc1,382.8856153
Cc1cc(N=Nc2ccc(O)c3ncccc23)no1,CO,490.0
Cc1cc(O)c(C(=O)/C=C/c2ccc(Cl)cc2)c(=O)o1,CC#N,357.0
Cc1cc(O)c(C(=O)/C=C/c2ccc(Cl)cc2)c(=O)o1,ClCCl,360.0
Cc1cc(O)c(C(=O)/C=C/c2ccc(Cl)cc2Cl)c(=O)o1,CC#N,349.0
Cc1cc(O)c(C(=O)/C=C/c2ccc(Cl)cc2Cl)c(=O)o1,ClCCl,350.0
Cc1cc(O)c(C(=O)/C=C/c2ccc(N(C)C)cc2)c(=O)o1,CC#N,463.0
Cc1cc(O)c(C(=O)/C=C/c2ccc(N(C)C)cc2)c(=O)o1,ClCCl,469.0
Cc1cc(O)c(C(=O)/C=C/c2cccc(O)c2)c(=O)o1,CC#N,367.0
Cc1cc(O)c(C(=O)/C=C/c2cccc(O)c2)c(=O)o1,ClCCl,374.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2)c(=O)o1,CC#N,356.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2)c(=O)o1,ClCCl,358.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2Cl)c(=O)o1,CC#N,353.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2Cl)c(=O)o1,ClCCl,355.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2O)c(=O)o1,CC#N,359.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2O)c(=O)o1,ClCCl,360.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2[N+](=O)[O-])c(=O)o1,CC#N,352.0
Cc1cc(O)c(C(=O)/C=C/c2ccccc2[N+](=O)[O-])c(=O)o1,ClCCl,365.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,C1CCCCC1,355.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,C1CCOC1,363.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,C1COCCO1,361.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CC#N,357.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CC(C)(C)O,368.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CC(C)O,367.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CCCCCC,353.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CCCCO,367.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CCO,364.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CCOC(C)=O,347.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CN(C)C=O,364.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CO,361.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,CS(C)=O,366.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,ClC(Cl)Cl,344.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,ClCCl,343.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,O,358.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc(C(F)(F)F)cc1,OCCO,363.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,C1CCCCC1,385.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,C1CCOC1,402.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,C1COCCO1,393.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CC#N,392.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CC(C)(C)O,407.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CC(C)O,404.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CCCCCC,383.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CCCCO,405.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CCO,402.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CCOC(C)=O,397.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CN(C)C=O,407.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CO,399.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,CS(C)=O,410.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,398.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,ClCCl,392.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,O,395.0
Cc1cc(O)c(C(C)C)cc1/N=C/c1ccc([N+](=O)[O-])cc1,OCCO,401.0
Cc1cc(O)cc2occ(-c3ccc(O)cc3)c(=O)c12,O,287.0
Cc1cc(OCCO)c(C)cc1C=Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-],CO,417.0
Cc1cc2c(-c3cc(Cl)c(Cl)cc3C(=O)N(C)CCCC(=O)O)c3cc(C)c(NCCCS(=O)(=O)O)cc3[o+]c2cc1NCCCS(=O)(=O)O,O,549.0
Cc1cc2c(-c3cc(Cl)c(Cl)cc3C(=O)N(C)CCCC(=O)O)c3cc(C)c(NCCCS(=O)(=O)O)cc3[o+]c2cc1NCCCS(=O)(=O)[O-],O,549.0
Cc1cc2c(-c3cc(Cl)c(Cl)cc3C(=O)N(C)CCCC(=O)O)c3cc(C)c(NCCCS(=O)(=O)[O-])cc3[o+]c2cc1NCCCS(=O)(=O)[O-],O,549.0
Cc1cc2c(C(=O)c3ccccc3C(=O)O)c3c(n2cc1C)C(=O)c1ccccc1C3=O,CN(C)C=O,509.0
Cc1cc2c(cc1N1c3ccccc3C(C)(C)c3ccccc31)C(C)(C)c1cc(N3c4ccccc4C(C)(C)c4ccccc43)c(C)cc1S2(=O)=O,ClCCl,359.0
Cc1cc2c(cc1[N+](=O)[O-])NC(=O)CC(=O)N2,CS(C)=O,311.0
Cc1cc2c(ccc3c(C)[n+](C)c(C)cc32)c(C)[n+]1C,CC#N,406.0
Cc1cc2c(ccc3c[n+](C)c(C)cc32)c[n+]1C,CC#N,400.0
Cc1cc2c(o1)=CC1=Cc3c(C)cc(C)n3[B-](F)(F)[N+]=21,ClC(Cl)Cl,542.0
Cc1cc2c(o1)=CC1=Cc3cc4oc(C)cc4n3[B-](F)(F)[N+]=21,ClC(Cl)Cl,579.0
Cc1cc2c(o1)c(Br)cc1c(C)cc(=O)oc12,C1CCCCC1,330.0
Cc1cc2c(o1)c(Br)cc1c(C)cc(=O)oc12,CCO,330.0
Cc1cc2c(o1)c(C)cc1ccc(=O)oc12,C1CCCCC1,330.0
Cc1cc2c(o1)c(C)cc1ccc(=O)oc12,C1COCCO1,315.0
Cc1cc2c(o1)c(C)cc1ccc(=O)oc12,CC#N,315.0
Cc1cc2c(o1)c(C)cc1ccc(=O)oc12,CCO,305.0
Cc1cc2c(o1)c(C)cc1ccc(=O)oc12,OCC(F)(F)F,310.0
Cc1cc2c3c(ccc4c3c1OC(c1ccccc1)=C4c1ccccc1)C(c1ccccc1)=C(c1ccccc1)O2,ClCCl,499.0
Cc1cc2c3ccccc3[nH]c2c2[nH]c3ccccc3c12,ClCCl,323.0
Cc1cc2c3ccccc3n(C)c2c2c1c1ccccc1n2C,ClCCl,329.0
Cc1cc2c3ccccc3oc2c2[nH]c3ccccc3c12,ClCCl,314.0
Cc1cc2c3ccccc3sc2c2[nH]c3ccccc3c12,ClCCl,320.0
Cc1cc2cc(C)c3c4ccccc4[nH]c3c2s1,ClCCl,312.0
Cc1cc2cc(N3c4ccccc4Oc4ccccc43)ccc2c(=O)o1,Cc1ccccc1,395.0
Cc1cc2cc3c(cc2s1)sc1cc2sc(C)cc2cc13,C1CCOC1,268.0
Cc1cc2cc3cc(C)c(C)cc3cc2cn1,CCO,383.2886163
Cc1cc2ccc(-c3ccccc3)c3c(-c4ccccc4)nc1n23,CO,468.0
Cc1cc2cccc3c(-c4ccccc4)nc1n23,CO,450.0
Cc1cc2cccc3cnc1n32,CO,411.0
Cc1cc2ccccc2c2c1c1ccccc1n2-c1ccc(C#N)cc1,ClCCl,303.0
Cc1cc2ccccc2c2c1c1ccccc1n2-c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,304.0
Cc1cc2ccccc2c2c1c1ccccc1n2-c1ccccc1,ClCCl,303.0
Cc1cc2ccccc2c2c1c1ccccc1n2-c1ncccn1,ClCCl,303.0
Cc1cc2ccccc2c2c1c1ccccc1n2C,ClCCl,300.0
Cc1cc2ccccc2c2c1c1ccccc1n2C(=O)OC(C)(C)C,ClCCl,300.0
Cc1cc2ccccc2cc1C,C1CCCCC1,304.136253
Cc1cc2ccsc2c2[nH]c3ccccc3c12,ClCCl,310.0
Cc1cc2nc(N=Nc3c(-c4ccccc4)[nH]c4ccccc34)sc2cc1C,ClC(Cl)Cl,541.0
Cc1cc2nc(N=Nc3c(-c4ccccc4)n(C)c4ccccc34)sc2cc1C,ClC(Cl)Cl,531.0
Cc1cc2nc(N=Nc3c(C)[nH]c4ccccc34)sc2cc1C,ClC(Cl)Cl,513.0
Cc1cc2nc(N=Nc3ccc(O)c4ncccc34)sc2cc1C,CS(C)=O,570.0
Cc1cc2nc3[nH]c(=O)[nH]c(=O)c3nc2cc1C,CC#N,380.0
Cc1cc2nc3c(=O)[nH]c(=O)n(C)c3nc2cc1C,CC#N,379.0
Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(C)c2cc1C,CC#N,443.0
Cc1cc2nc3c(=O)n(C)c(=O)n(C)c3nc2cc1C,CC#N,375.0
Cc1cc2nc3cc(C)c(N)cc3[n+](-c3ccccc3)c2cc1N,CC(C)O,537.1
Cc1cc2nc3cc(C)c(N)cc3[n+](-c3ccccc3)c2cc1N,CCO,534.0
Cc1cc2nc3cc(C)c(N)cc3[n+](-c3ccccc3)c2cc1N,CO,529.0
Cc1cc2nc3cc(C)c(N)cc3[n+](-c3ccccc3)c2cc1N,O,520.0
Cc1ccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c(O)c1,CC#N,393.0
Cc1ccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c(O)c1,CO,397.0
Cc1ccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c(O)c1,ClCCl,393.0
Cc1ccc(-c2[o+]c3c(-c4ccc(C)cc4)c(-c4ccc(C)cc4)c4cccc5ccc(c2-c2ccc(C)cc2)c3c54)cc1,ClCCl,507.0
Cc1ccc(-c2c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)n3c(c2-c2ccc(C)cc2)c(C=O)c2ccccc23)cc1,CC#N,415.0
Cc1ccc(-c2c(-c3ccc(C)cc3)c(-c3ccc(C)cc3)n3c(c2-c2ccc(C)cc2)c(C=O)c2ccccc23)cc1,CS(C)=O,417.0
Cc1ccc(-c2c(-c3ccc(C)cc3)c3cc(C(C)(C)C)cc4c(-c5ccc(C)cc5)c(-c5ccc(C)cc5)c5cccc2c5[n+]34)cc1,ClCCl,356.0
Cc1ccc(-c2c3c(n4ccc(C)cc24)C(=O)N(CCNC(=O)OC(C)(C)C)C3)cc1,ClCCl,344.0
Cc1ccc(-c2c3cc(Br)sc3c(-c3ccc(C)s3)c3cc(Br)sc23)s1,ClC(Cl)Cl,348.0
Cc1ccc(-c2c3cc(C=O)ccc3nn2C)o1,CC#N,368.0
Cc1ccc(-c2c3cc(C=O)ccc3nn2C)o1,ClCCl,369.0
Cc1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,CC#N,367.0
Cc1ccc(-c2c3cc(N(C)C)ccc3nn2C)o1,ClCCl,368.0
Cc1ccc(-c2c3cc(N(C)C)ccc3nn2C)s1,CC#N,362.0
Cc1ccc(-c2c3cc(N(C)C)ccc3nn2C)s1,ClCCl,364.0
Cc1ccc(-c2c3ccc(=[NH2+])cc-3n(C)c3cc(N(C)C)ccc23)cc1,O,485.0
Cc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N(C)C)ccc23)cc1,O,525.0
Cc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N)ccc23)cc1,O,500.0
Cc1ccc(-c2c3ccc(=[NH2+])cc-3oc3cc(N4CCCCC4)ccc23)cc1,O,535.0
Cc1ccc(-c2c3ccc(=[NH2+])cc-3sc3cc(N)ccc23)cc1,O,520.0
Cc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc(C#N)cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4ccc2o4)C=C3)cc1,C1CCOC1,451.0
Cc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc(C#N)cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4ccc2o4)C=C3)cc1,Cc1ccccc1,452.0
Cc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc(C#N)cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4ccc2o4)C=C3)cc1,c1ccccc1,452.0
Cc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4ccc2o4)C=C3)cc1,C1CCOC1,445.0
Cc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4ccc2o4)C=C3)cc1,Cc1ccccc1,448.0
Cc1ccc(-c2c3ccc([nH]3)c3nc(c(-c4ccc([N+](=O)[O-])cc4)c4ccc([nH]4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4ccc2o4)C=C3)cc1,c1ccccc1,448.0
Cc1ccc(-c2c3ccccc3nn2C)o1,CC#N,335.0
Cc1ccc(-c2c3ccccc3nn2C)o1,ClCCl,338.0
Cc1ccc(-c2c3ccccc3nn2C)s1,CC#N,326.0
Cc1ccc(-c2c3ccccc3nn2C)s1,ClCCl,327.0
Cc1ccc(-c2c3nc(c(-c4ccc(C(=O)O)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)O)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2s5)C=C4)C=C3)cc1,C1CCOC1,428.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc(C(=O)O)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClC(Cl)Cl,648.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,417.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4N2CCOCC2)C=C3)cc1,CS(C)=O,653.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc(OC(=O)C(C)c5ccc(-c6ccccc6)c(F)c5)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,649.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc(OC(=O)C(C)c5cccc(C(=O)c6ccccc6)c5)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,649.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccc([N+](=O)[O-])cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,416.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc([nH]4)c(-c4ccco4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,423.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc(s4)c(-c4ccc(C(=O)O)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,C1CCOC1,428.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc(s4)c(-c4ccc(C)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,428.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc(s4)c(-c4ccc(C)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2s5)C=C4)C=C3)cc1,ClCCl,435.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc(s4)c(-c4ccco4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,436.0
Cc1ccc(-c2c3nc(c(-c4ccc(C)cc4)c4ccc(s4)c(-c4ccco4)c4nc(c(-c5ccc(C)cc5)c5ccc2s5)C=C4)C=C3)cc1,ClCCl,442.0
Cc1ccc(-c2c3nc(c(-c4ccco4)c4ccc([nH]4)c(-c4ccc(C)cc4)c4nc(c(-c5ccco5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,426.0
Cc1ccc(-c2c3nc(c(-c4ccco4)c4ccc([nH]4)c(-c4ccco4)c4nc(c(-c5ccco5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,430.0
Cc1ccc(-c2c3nc(c(-c4ccco4)c4ccc([nH]4)c(-c4ccco4)c4nc(c(-c5ccco5)c5ccc2s5)C=C4)C=C3)cc1,ClCCl,442.0
Cc1ccc(-c2c3nc(c(-c4ccco4)c4ccc(s4)c(-c4ccco4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,442.0
Cc1ccc(-c2c3nc(c(-c4ccco4)c4ccc(s4)c(-c4ccco4)c4nc(c(-c5ccc(C)cc5)c5ccc2s5)C=C4)C=C3)cc1,ClCCl,448.0
Cc1ccc(-c2c3nc(c(-c4ccco4)c4ccc(s4)c(-c4ccco4)c4nc(c(-c5ccco5)c5ccc2s5)C=C4)C=C3)cc1,ClCCl,452.0
Cc1ccc(-c2c3nc(c(C#Cc4ccc(C(=O)O)cc4)c4ccc(s4)c(-c4ccc(C)cc4)c4nc(c(-c5ccc(C)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,C1CCOC1,444.0
Cc1ccc(-c2cc(-c3ccc(C)cc3)c(C#N)c(=O)[nH]2)cc1,C1CCOC1,374.0
Cc1ccc(-c2cc(-c3ccc(C)cc3)c(C#N)c(=O)[nH]2)cc1,CC#N,373.0
Cc1ccc(-c2cc(-c3ccc(C)cc3)c(C#N)c(=O)[nH]2)cc1,CCOC(C)=O,374.0
Cc1ccc(-c2cc(-c3ccc(C)cc3)c(C#N)c(=O)[nH]2)cc1,CN(C)C=O,377.0
Cc1ccc(-c2cc(-c3ccc(C)cc3)c(C#N)c(=O)[nH]2)cc1,CO,366.0
Cc1ccc(-c2cc(-c3ccc(C)cc3)c(C#N)c(=O)[nH]2)cc1,CS(C)=O,383.0
Cc1ccc(-c2cc(-c3ccc(C)cc3)c(C#N)c(=O)[nH]2)cc1,ClC(Cl)Cl,370.0
Cc1ccc(-c2cc(-c3ccc(N(C)C)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC#N,410.0
Cc1ccc(-c2cc(-c3ccc(N(C)C)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC(C)=O,412.0
Cc1ccc(-c2cc(-c3ccc(N(C)C)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC(C)O,410.0
Cc1ccc(-c2cc(-c3ccc(N(C)C)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CO,408.0
Cc1ccc(-c2cc(-c3ccc(N(C)C)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,ClC(Cl)Cl,416.0
Cc1ccc(-c2cc(-c3ccc(N(C)C)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,ClCCl,414.0
Cc1ccc(-c2cc(-c3ccc(N(C)C)cc3)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,c1ccccc1,418.0
Cc1ccc(-c2cc(-c3ccccc3Cl)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC#N,414.0
Cc1ccc(-c2cc(-c3ccccc3Cl)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC(C)=O,422.0
Cc1ccc(-c2cc(-c3ccccc3Cl)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CC(C)O,414.0
Cc1ccc(-c2cc(-c3ccccc3Cl)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,CO,416.0
Cc1ccc(-c2cc(-c3ccccc3Cl)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,ClC(Cl)Cl,418.0
Cc1ccc(-c2cc(-c3ccccc3Cl)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,ClCCl,422.0
Cc1ccc(-c2cc(-c3ccccc3Cl)c3c(N)nc(N4CCCC4)c(C#N)c3n2)cc1,c1ccccc1,426.0
Cc1ccc(-c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(-c3ccc(C)cc3)cc2/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,410.0
Cc1ccc(-c2cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)c(N3CCCCC3)c2)cc1,CS(C)=O,401.0
Cc1ccc(-c2cc(C)[o+]c(C)c2)cc1,CC#N,347.0
Cc1ccc(-c2cc(C)[o+]c(C)c2)cc1,ClCCl,365.0
Cc1ccc(-c2cc3ccccc3oc2=O)cc1,C1CCOC1,328.0
Cc1ccc(-c2cc3ccccc3oc2=O)cc1,CCCCCC,328.0
Cc1ccc(-c2cc3ccccc3oc2=O)cc1,CCO,328.0
Cc1ccc(-c2cc3ccccc3oc2=O)cc1,CS(C)=O,330.0
Cc1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc(C)cc5)cc4)c(/C(=C(/c4ccccc4)c4cc(-c5ccc(-c6ccc(C)cc6)cc5)ccc4-c4ccc(-c5ccc(C)cc5)cc4)c4ccccc4)c3)cc2)cc1,C1CCOC1,308.0
Cc1ccc(-c2ccc(-c3ccc(-c4ccc(C)cc4)cc3/C(=C(/c3ccccc3)c3cc(-c4ccc(C)cc4)ccc3-c3ccc(-c4ccc(C)cc4)cc3)c3ccccc3)cc2)cc1,C1CCOC1,295.0
Cc1ccc(-c2ccc(-c3ccc(C)cc3)c(/C(=C(/c3ccccc3)c3cc(-c4ccc(C)cc4)ccc3-c3ccc(C)cc3)c3ccccc3)c2)cc1,C1CCOC1,282.0
Cc1ccc(-c2ccc(/C=C/c3ccc(Br)n3C)cn2)nc1,CC#N,373.0
Cc1ccc(-c2ccc(/C=C/c3ccc(C#N)cc3)cn2)nc1,CC#N,343.0
Cc1ccc(-c2ccc(/C=C/c3ccc(Cl)cc3)cn2)nc1,CC#N,337.0
Cc1ccc(-c2ccc(/C=C/c3ccc(F)cc3)cn2)nc1,CC#N,334.0
Cc1ccc(-c2ccc(/C=C/c3ccc([N+](=O)[O-])cc3)cn2)nc1,CC#N,349.0
Cc1ccc(-c2ccc(/C=C/c3ccccc3)cn2)nc1,CC#N,335.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,C1COCCO1,381.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,CC#N,378.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,CCCCCC,372.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,CCO,383.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,CN(C)C=O,384.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,CO,382.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,CS(C)=O,388.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,Cc1ccccc1,382.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,ClC(Cl)Cl,380.0
Cc1ccc(-c2ccc(/C=C/c3cccn3C)cn2)nc1,c1ccccc1,382.0
Cc1ccc(-c2ccc(/C=C/c3cccs3)cn2)nc1,CC#N,348.0
Cc1ccc(-c2ccc(Br)s2)s1,ClC(Cl)Cl,942.0
Cc1ccc(-c2ccc(C(=O)NC(C)(C)C)c3c2ccc2c4ccccc4c4ccccc4c23)cc1,ClCCl,341.0
Cc1ccc(-c2ccc(C(C#N)=Cc3ccc(-c4csc(C=C(C#N)c5ccccc5)c4)cc3)cc2)cc1,C1CCOC1,368.0
Cc1ccc(-c2ccc(C(C#N)=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1,C1CCCCC1,417.0
Cc1ccc(-c2ccc3cc4ccccc4nc3n2)cc1,CC(C)=O,388.0
Cc1ccc(-c2ccc3ccc4cc(C(C)(C)C)cc5ccc2c3c45)cc1,C1CCOC1,342.0
Cc1ccc(-c2ccc3ccc4cc(C(C)(C)C)cc5ccc2c3c45)cc1,ClCCl,342.0
Cc1ccc(-c2cccc3ncc(-c4ccccc4)n23)cc1,ClCCl,341.0
Cc1ccc(-c2ccccc2)cc1,C1CCCCC1,257.4002574
Cc1ccc(-c2ccnc3nc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)nn23)cc1,ClCCl,309.0
Cc1ccc(-c2ccnc3ncnn23)cc1,ClCCl,312.0
Cc1ccc(-c2cnc3ccc4ccccc4n23)cc1,ClCCl,324.0
Cc1ccc(-c2cnc3nn4ccccc4c3c2)cc1,C1CCOC1,386.0
Cc1ccc(-c2cnc3nn4ccccc4c3n2)cc1,C1CCOC1,400.0
Cc1ccc(-c2coc3cc(O)ccc3c2=O)cc1,O,336.0
Cc1ccc(-c2nc(-c3cc([N+](=O)[O-])ccc3O)[nH]c2-c2ccc(C)cc2)cc1,CO,284.0
Cc1ccc(-c2nc(-c3ccc(-c4nc(-c5ccc(C)cc5)c(-c5ccc(C)cc5)[nH]4)cc3)[nH]c2-c2ccc(C)cc2)cc1,CS(C)=O,395.0
Cc1ccc(-c2nc(-c3ccc(O)cc3)[nH]c2-c2ccc(C)cc2)cc1,CO,295.0
Cc1ccc(-c2nc(-c3cccc(C#N)c3)[nH]c2-c2ccc(C)cc2)cc1,CO,315.0
Cc1ccc(-c2nc(-c3cccc(O)c3)[nH]c2-c2ccc(C)cc2)cc1,CO,300.0
Cc1ccc(-c2nc(/C=C/c3ccc(Cl)cc3)c(/C=C/c3ccc(Cl)cc3)[nH]2)cc1,ClCCl,385.0
Cc1ccc(-c2nc(/C=C/c3ccccc3)c(/C=C/c3ccccc3)[nH]2)cc1,ClCCl,355.0
Cc1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,C1CCOC1,466.0
Cc1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CC#N,470.0
Cc1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CCCCCC,446.0
Cc1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CS(C)=O,485.0
Cc1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,Cc1ccccc1,461.0
Cc1ccc(-c2nc(N(c3ccccc3)c3ccccc3)sc2-c2ccc([N+](=O)[O-])s2)cc1,ClCCl,476.0
Cc1ccc(-c2nc(N3CCCCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,C1CCOC1,477.0
Cc1ccc(-c2nc(N3CCCCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CC#N,483.0
Cc1ccc(-c2nc(N3CCCCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CCCCCC,450.0
Cc1ccc(-c2nc(N3CCCCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CS(C)=O,501.0
Cc1ccc(-c2nc(N3CCCCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,Cc1ccccc1,474.0
Cc1ccc(-c2nc(N3CCCCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,ClCCl,489.0
Cc1ccc(-c2nc(N3CCOCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,C1CCOC1,468.0
Cc1ccc(-c2nc(N3CCOCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CC#N,468.0
Cc1ccc(-c2nc(N3CCOCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CCCCCC,434.0
Cc1ccc(-c2nc(N3CCOCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,CS(C)=O,490.0
Cc1ccc(-c2nc(N3CCOCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,Cc1ccccc1,465.0
Cc1ccc(-c2nc(N3CCOCC3)sc2-c2ccc([N+](=O)[O-])s2)cc1,ClCCl,474.0
Cc1ccc(-c2nc3c4ccccc4c4cccc2n43)cc1,CO,484.0
Cc1ccc(-c2nc3cc4c(cc3[nH]2)-c2ccccc2C4C)cc1,CS(C)=O,357.0
Cc1ccc(-c2nc3ccc(-c4ccc5nc(-c6ccc(C)cc6)oc5c4)cc3o2)cc1,CCCCCCC,331.0
Cc1ccc(-c2nc3ccc4c(c3nc2-c2ccc(C)cc2)C(=O)c2ccccc2C4=O)cc1,CCCCCC,266.0
Cc1ccc(-c2nc3cnccn3c2NC2CCCCC2)o1,CS(C)=O,368.0
Cc1ccc(-c2nc3nccc(-c4cc(C(F)(F)F)cc(C(F)(F)F)c4)n3n2)cc1,ClCCl,324.0
Cc1ccc(-c2nc3nccc(-c4ccc(N(C)C)cc4)n3n2)cc1,ClCCl,391.0
Cc1ccc(-c2nc3sc4ccccc4c3s2)cc1,CS(C)=O,349.0
Cc1ccc(-c2ncc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)o2)c(O)c1,Cc1ccccc1,366.0
Cc1ccc(-c2ncc3ccc4ccccc4n23)cc1,ClCCl,324.0
Cc1ccc(-c2nnc(-c3cc(-c4ccc(Cl)cc4)nn3Cc3ccc(C(C)(C)C)cc3)o2)cc1,ClCCl,275.0
Cc1ccc(-c2nnc(-c3cc(-c4ccc(Cl)cc4)nn3Cc3ccc(Cl)nc3)o2)cc1,ClCCl,275.0
Cc1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,C1CCOC1,392.0
Cc1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,CC#N,390.0
Cc1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,CC1CCCCC1,391.0
Cc1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,CCCCCC,391.0
Cc1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,Cc1ccccc1,394.0
Cc1ccc(-c2nnc(-c3ccc4ccc5cccc6ccc3c4c56)o2)cc1,ClC(Cl)Cl,394.0
Cc1ccc(-c2nnc(-c3ccn4c(C)nc(Cl)c4c3)o2)cc1,ClCCl,294.0
Cc1ccc(-c2nnc3ccccn23)cc1,ClCCl,283.0
Cc1ccc(-c2oc3cccc4c5c(-c6ccc(C)cc6)/c(=N/S(=O)(=O)C(F)(F)F)oc6cccc(c2c34)c65)cc1,ClC(Cl)Cl,470.0
Cc1ccc(-c2oc3cccc4c5c(-c6ccc(C)cc6)c(=N)oc6cccc(c2c34)c65)cc1,ClC(Cl)Cl,400.0
Cc1ccc(-c2sc(/C(C#N)=C/c3ccc(C#N)cc3)nc2-c2ccc(Cl)cc2)cc1,CC#N,383.0
Cc1ccc(-n2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,C1CCOC1,314.0
Cc1ccc(-n2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,CC(C)O,309.0
Cc1ccc(-n2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,CCCCCC,314.0
Cc1ccc(-n2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,CO,309.0
Cc1ccc(-n2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,CS(C)=O,313.0
Cc1ccc(-n2c(-c3ccc(C(F)(F)F)cc3)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,ClCCl,311.0
Cc1ccc(-n2c(-c3ccc(N(c4ccc(-c5ccc(N(c6ccc(-c7nc8c9ccccc9c9ccccc9c8n7-c7ccc(C)cc7)cc6)c6ccc(-c7nc8c9ccccc9c9ccccc9c8n7-c7ccc(C)cc7)cc6)cc5)cc4)c4ccc(-c5nc6c7ccccc7c7ccccc7c6n5-c5ccc(C)cc5)cc4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,ClCCl,376.0
Cc1ccc(-n2c(-c3cccc4cc[n-]c34)[nH+]c3c4ccccc4c4ccccc4c32)cc1,Cc1ccccc1,373.0
Cc1ccc(-n2c(-c3cccc4cc[nH]c34)nc3c4ccccc4c4ccccc4c32)cc1,Cc1ccccc1,354.0
Cc1ccc(-n2c(-c3ccccc3N)nc3c4ccccc4c4ccccc4c32)cc1,Cc1ccccc1,311.0
Cc1ccc(-n2c(-c3ccccc3O)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,C1CCOC1,307.0
Cc1ccc(-n2c(-c3ccccc3O)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,CC(C)O,303.0
Cc1ccc(-n2c(-c3ccccc3O)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,CO,303.0
Cc1ccc(-n2c(-c3ccccc3O)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,CS(C)=O,306.0
Cc1ccc(-n2c(-c3ccccc3O)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,ClC(Cl)Cl,310.0
Cc1ccc(-n2c(-c3ccccc3O)nc(-c3ccccc3O)c2-c2ccccc2O)cc1,ClCCl,309.0
Cc1ccc(-n2c(-c3ccccc3[N-]S(=O)(=O)c3ccc(C)cc3)[nH+]c3c4ccccc4c4ccccc4c32)cc1,Cc1ccccc1,361.0
Cc1ccc(-n2c(-c3ccccc3[NH-])[nH+]c3c4ccccc4c4ccccc4c32)cc1,Cc1ccccc1,363.0
Cc1ccc(-n2c(C)ccc2C)cc1,CC#N,234.0
Cc1ccc(-n2c(C)ccc2C)cc1,CCCCCC,238.0
Cc1ccc(-n2c3ccc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)cc3c3cc(-c4ccc(-c5nc6ccccc6n5-c5ccccc5)cc4)ccc32)cc1,ClC(Cl)Cl,318.0
Cc1ccc(-n2c3ccccc3c3cc(-c4ccc5[n+](c4)[B-](F)(F)n4c-5nc5c6ccccc6c6ccccc6c54)ccc32)cc1,ClC(Cl)Cl,444.0
Cc1ccc(-n2c3ccccc3c3cc(/C=C/C(=O)O)ccc32)cc1,CC#N,400.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,C1CCOC1,442.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CC#N,445.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CC(C)=O,442.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CCOC(C)=O,442.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CO,447.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,CS(C)=O,453.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,Cc1ccccc1,447.0
Cc1ccc(-n2c3ccccc3c3cc(C(=C(C#N)C#N)c4ccccc4)ccc32)cc1,ClC(Cl)Cl,458.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,C1CCOC1,407.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,CC#N,402.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,CC(C)=O,402.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,CCOC(C)=O,400.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,CO,402.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,CS(C)=O,407.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,Cc1ccccc1,406.0
Cc1ccc(-n2c3ccccc3c3cc(C=C(C#N)C#N)ccc32)cc1,ClC(Cl)Cl,413.0
Cc1ccc(-n2cc3ccccc3c/c2=N/S(=O)(=O)c2ccc(C)cc2)cc1,CC#N,434.0
Cc1ccc(-n2cccc2)cc1,CC#N,254.0
Cc1ccc(-n2cccc2)cc1,CCCCCC,254.0
Cc1ccc(-n2cccc2)cc1,ClC(Cl)Cl,315.0
Cc1ccc(/C(C#N)=C/c2cc(/C=C(\C#N)c3ccc(C)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCCCC1,385.0
Cc1ccc(/C(C#N)=C/c2cc(/C=C(\C#N)c3ccc(C)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,391.0
Cc1ccc(/C(C#N)=C/c2cc(/C=C(\C#N)c3ccc(C)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CCCCCC,385.0
Cc1ccc(/C(C#N)=C/c2cc(/C=C(\C#N)c3ccc(C)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CCOC(C)=O,393.0
Cc1ccc(/C(C#N)=C/c2cc(/C=C(\C#N)c3ccc(C)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,Cc1ccccc1,391.0
Cc1ccc(/C(C#N)=C/c2cc(/C=C(\C#N)c3ccc(C)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClC(Cl)Cl,385.0
Cc1ccc(/C(C#N)=C/c2cc(/C=C(\C#N)c3ccc(C)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,393.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2\N=C(/C=4c3ccc(C)cc3)c3c(-c4c(Cl)cccc4Cl)noc32)cc1,CCO,614.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2\N=C(/C=4c3ccc(C)cc3)c3onc(-c4c(Cl)cccc4Cl)c32)cc1,CCO,613.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2ccc(C)cc2)cc1,ClC(Cl)Cl,594.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2ccc(C)cc2)cc1,ClCCl,588.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2/C=C(c3ccc(/C=C(\C#N)C(=O)O)o3)C(=N2)/C=4c2ccc(C)cc2)cc1,C1CCOC1,607.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2/C=C(c3ccc(C=C(C(=O)O)C(=O)O)o3)C(=N2)/C=4c2ccc(C)cc2)cc1,C1CCOC1,607.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2/C=CC(=N2)/C=4c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)o3)cc2)cc1,C1CCOC1,597.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2/C=CC(=N2)/C=4c2ccc(-c3ccc(C=C(C(=O)O)C(=O)O)o3)cc2)cc1,C1CCOC1,598.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2\N=C(/C=4c3ccc(C(=O)O)cc3)c3c(-c4c(Cl)cccc4Cl)noc32)cc1,CCO,612.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2\N=C(/C=4c3ccc(C(=O)O)cc3)c3onc(-c4c(Cl)cccc4Cl)c32)cc1,CCO,612.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2\N=C(C=C2/C=C(\C#N)C(=O)O)/C=4c2ccc(C)cc2)cc1,ClCCl,622.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C)cc2)=C2\N=C(C=C2C#Cc2ccc(C(=O)O)cc2)/C=4c2ccc(C)cc2)cc1,ClCCl,605.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2sc(-c3ccc(-c5cc(C)c(/C=C(\C#N)C(=O)O)s5)c5nsnc35)cc2C)=C2/C=CC(=N2)/C=4c2ccc(C)cc2)cc1,ClC(Cl)Cl,571.0
Cc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C)s3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2sc(/C=C(\C#N)C(=O)O)c3c2OCCO3)=C2/C=CC(=N2)/C=4c2ccc(C)s2)s1,ClC(Cl)Cl,559.0
Cc1ccc(/C2=c3\cc/c(o3)=C(\c3ccc(C)cc3)c3ccc([nH]3)-c3ccc4n3[B-](F)(F)[N+]3=C(C=CC3=C4c3ccc[nH]3)c3ccc2[nH]3)cc1,ClC(Cl)Cl,717.0
Cc1ccc(/C2=c3\cc/c(o3)=C(\c3ccc(C)cc3)c3ccc([nH]3)-c3ccc4n3[B-](F)(F)[N+]3=C(C=CC3=C4c3ccco3)c3ccc2[nH]3)cc1,ClC(Cl)Cl,722.0
Cc1ccc(/C2=c3\cc/c(o3)=C(\c3ccc(C)cc3)c3ccc([nH]3)-c3ccc4n3[B-](F)(F)[N+]3=C(C=CC3=C4c3cccs3)c3ccc2[nH]3)cc1,ClC(Cl)Cl,709.0
Cc1ccc(/C2=c3\cc/c(o3)=C(\c3ccc(C)cc3)c3ccc([nH]3)-c3ccc4n3[P-](=O)(=O)[N+]3=C(C=CC3=C4c3ccc[nH]3)c3ccc2[nH]3)cc1,ClC(Cl)Cl,723.0
Cc1ccc(/C2=c3\cc/c(o3)=C(\c3ccc(C)cc3)c3ccc([nH]3)-c3ccc4n3[P-](=O)(=O)[N+]3=C(C=CC3=C4c3ccco3)c3ccc2[nH]3)cc1,ClC(Cl)Cl,744.0
Cc1ccc(/C2=c3\cc/c(o3)=C(\c3ccc(C)cc3)c3ccc([nH]3)-c3ccc4n3[P-](=O)(=O)[N+]3=C(C=CC3=C4c3cccs3)c3ccc2[nH]3)cc1,ClC(Cl)Cl,739.0
Cc1ccc(/C=C(\C#N)c2nc3ccccc3s2)cc1,C1CCCCC1,350.0
Cc1ccc(/C=C(\C#N)c2nc3ccccc3s2)cc1,CO,355.0
Cc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3o2)cc1,C1CCCCC1,325.0
Cc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3o2)cc1,CO,330.0
Cc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3s2)cc1,C1CCCCC1,340.0
Cc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3s2)cc1,CO,345.0
Cc1ccc(/C=C/C(F)(F)F)c(N)c1,C1CCOC1,346.0
Cc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c(Br)c1,CS(C)=O,557.0
Cc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1,CS(C)=O,557.0
Cc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1Cl,CS(C)=O,562.0
Cc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)cc1[N+](=O)[O-],CS(C)=O,555.0
Cc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)o1,CS(C)=O,573.0
Cc1ccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)s1,CS(C)=O,574.0
Cc1ccc(/C=C/c2ccccc2-[n+]2cc([O-])on2)cc1,C1CCCCC1,310.0
Cc1ccc(/C=C/c2ccccc2-[n+]2cc([O-])on2)cc1,CC#N,304.0
Cc1ccc(/C=C/c2ccccc2-[n+]2noc([O-])c2-c2ccccc2)cc1,C1CCCCC1,316.0
Cc1ccc(/C=C/c2ccccc2-[n+]2noc([O-])c2-c2ccccc2)cc1,CC#N,313.0
Cc1ccc(/C=C/c2ccccc2-[n+]2noc([O-])c2-c2ccccc2)cc1,CCO,315.0
Cc1ccc(/C=C/c2ccccc2-[n+]2noc([O-])c2C)cc1,C1CCCCC1,314.0
Cc1ccc(/C=C/c2ccccc2-[n+]2noc([O-])c2C)cc1,CC#N,310.0
Cc1ccc(/C=C/c2ccccc2-[n+]2noc([O-])c2C)cc1,CCO,312.0
Cc1ccc(/C=C/c2nc(-c3ccc([N+](=O)[O-])cc3)[nH]c2/C=C/c2ccc(C)cc2)cc1,ClCCl,445.0
Cc1ccc(/C=C/c2nc(-c3cccc([N+](=O)[O-])c3)[nH]c2/C=C/c2ccc(C)cc2)cc1,ClCCl,370.0
Cc1ccc(/C=C/c2nc(-c3ccccc3)[nH]c2/C=C/c2ccc(C)cc2)cc1,ClCCl,365.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,C1CCCCC1,341.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,C1CCOC1,348.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,C1COCCO1,344.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CC#N,337.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CC(C)(C)O,346.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CC(C)O,345.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCCCCC,340.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCCCO,345.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCO,344.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CCOC(C)=O,344.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CN(C)C=O,347.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CO,344.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,CS(C)=O,348.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,ClC(Cl)Cl,346.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,ClCCl,341.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,O,346.0
Cc1ccc(/C=N/c2cc(C(C)C)c(O)cc2C)cc1,OCCO,344.0
Cc1ccc(/C=c2\o/c(=C\c3ccccc3)c3ccccc23)cc1,ClCCl,373.0
Cc1ccc(/N=C2/C3=c4[nH]c5ccccc5c4=[N+](c4ccc(C)cc4)[B-](F)(F)N3c3ccccc32)cc1,ClCCl,649.0
Cc1ccc(/N=C2\N=C(N)c3cccc4cccc2c34)cc1,ClCCl,349.0
Cc1ccc(C#Cc2c3cc4ccccc4cc3c(C#C[Si](C(C)C)(C(C)C)C(C)C)c3cc4ccccc4cc23)cc1,ClCCl,654.0
Cc1ccc(C#Cc2cc3ccccc3oc2=O)cc1,CC#N,345.0
Cc1ccc(C#Cc2ccc(C#Cc3ccc(C#Cc4ccccc4C#N)cc3C#N)cc2C#N)cc1,ClC(Cl)Cl,360.0
Cc1ccc(C#Cc2ccc(C(=O)c3cc(C#Cc4ccc(C)cc4)c4ccc5c(C#Cc6ccc(C)cc6)cc(C#Cc6ccc(C)cc6)c6ccc3c4c56)cc2)cc1,CCCCCC,458.0
Cc1ccc(C#Cc2ccc3ccc(=O)oc3c2)cc1,CC#N,304.0
Cc1ccc(C#Cc2ccc3ccc4cccc5ccc2c3c45)cc1,CCCCCC,362.0
Cc1ccc(C#Cc2ccc3ccc4cccc5ccc2c3c45)cc1,CCO,362.0
Cc1ccc(C#Cc2ccc3ccc4cccc5ccc2c3c45)cc1,CCOC(C)=O,362.0
Cc1ccc(C#Cc2ccc3ccc4cccc5ccc2c3c45)cc1,ClCCl,365.0
Cc1ccc(C#Cc2ccc3nc4ccc(C#Cc5ccc(C)cc5)cn4c(=O)c3c2)cc1,ClCCl,385.0
Cc1ccc(C#Cc2cccc(-c3cccc(C#Cc4ccc(C)s4)n3)n2)s1,CC#N,340.0
Cc1ccc(C(=Cc2ccc3ccccc3n2)NN=Cc2ccccc2)cc1,CCO,449.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,C1CCCCC1,333.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,C1COCCO1,334.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CC#N,332.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CC(C)(C)O,337.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CC(C)O,337.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CCCCCC,332.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CCCCO,338.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CCOC(C)=O,334.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CN(C)C=O,338.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,CO,339.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,ClCCl,337.0
Cc1ccc(C(=O)/C=C2\C(=O)Nc3ccccc32)cc1,O,338.0
Cc1ccc(C(=O)/N=c2\oc3cccc4c5c(-c6ccccc6)oc6cccc(c(c2-c2ccccc2)c34)c65)cc1,ClC(Cl)Cl,385.0
Cc1ccc(C(=O)NC(C)(C)C)c2c1ccc1c3ccccc3c3ccccc3c12,ClCCl,335.0
Cc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,C1CCOC1,366.0
Cc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CC#N,368.0
Cc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CC(C)=O,366.0
Cc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CCCCCO,376.0
Cc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,CO,374.0
Cc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,ClC(Cl)Cl,370.0
Cc1ccc(C(=O)NN2C3=C(CC4=C2CCCC4=O)C(=O)CCC3)cc1,ClCCl,366.0
Cc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)cc1,CS(C)=O,430.0
Cc1ccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)o1,CS(C)=O,431.0
Cc1ccc(C(=O)OCc2c(C)c(=O)n3c(=O)c(C)c(C)n23)cc1,CCO,376.0
Cc1ccc(C(=O)OCc2ccc3c4cccc5cccc(c6cccc2c63)c54)cc1,CCO,438.0
Cc1ccc(C(=O)[O-])c(O)c1,CO,292.0
Cc1ccc(C(=O)[O-])c(O)c1,O,295.0
Cc1ccc(C(=O)c2c(C)c3ccc4cccc5c6cccc7ccc2c(c76)c3c45)cc1,ClCCl,391.0
Cc1ccc(C(C#N)=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCCCC1,402.0
Cc1ccc(C(c2ccc(C)cc2)c2ccc(N3c4ccc(/C=C(\C#N)C(=O)O)cc4Sc4cc(-c5ccc(N(c6ccccc6)c6cccc7ccccc67)cc5)ccc43)cc2)cc1,C1CCOC1,474.0
Cc1ccc(C)c(-c2cc3c4c(ccc5c4c2OC(c2ccccc2)=C5c2ccccc2)C(c2ccccc2)=C(c2ccccc2)O3)c1,ClCCl,497.0
Cc1ccc(C)c(C)c1,C1CCCCC1,263.7826431
Cc1ccc(C)c(C2=C3C=CC(=[N+](C)C)C=C3[Si](C)(C)c3cc(N(C)C)ccc32)c1,O,646.0
Cc1ccc(C)c2nc3c(=O)[nH]c(=O)[nH]c3nc12,CC#N,388.0
Cc1ccc(C)cc1,C1CCCCC1,262.8811777
Cc1ccc(C)n1-c1ccc(C#N)cc1,C1CCOC1,275.0
Cc1ccc(C)n1-c1ccc(C#N)cc1,CCCCCC,275.0
Cc1ccc(C)n1-c1ccc(C#N)cc1,CCCCCl,275.0
Cc1ccc(C)n1-c1ccc(C#N)cc1,CCOCC,275.0
Cc1ccc(C)n1-c1ccc(N(C)C)cc1,CC#N,306.0
Cc1ccc(C)n1-c1ccc(N(C)C)cc1,CCCCCC,304.0
Cc1ccc(C)n1-c1cccc(C#N)c1,ClCCl,259.0
Cc1ccc(C)n1-c1ccccc1,CC#N,234.0
Cc1ccc(C)n1-c1ccccc1,CCCCCC,240.0
Cc1ccc(C2(c3ccc(C)cc3)c3cc(-c4ccc(C=C(C#N)C(=O)O)s4)cc4c3N3c5c2cc(-c2ccc(C=C(C#N)C(=O)O)s2)cc5C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(C=C(C#N)C(=O)O)s5)cc(c23)C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClCCl,494.0
Cc1ccc(C2(c3ccc(C)cc3)c3cccc4c3N3c5c2cccc5C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)cc(c23)C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClCCl,426.0
Cc1ccc(C2(c3ccc(C)cc3)c3cccc4c3N3c5c2cccc5C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc(c23)C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClC(Cl)Cl,488.0
Cc1ccc(C2(c3ccc(C)cc3)c3cccc4c3N3c5c2cccc5C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc(c23)C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClCCl,488.0
Cc1ccc(C2(c3ccc(C)cc3)c3cccc4c3N3c5c2cccc5C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(/C=C6/SC(=S)N(CC(=O)O)C6=O)s5)cc(c23)C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClCCl,523.0
Cc1ccc(C2(c3ccc(C)cc3)c3cccc4c3N3c5c2cccc5C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c5ccc(C=C(C#N)C(=O)O)s5)cc(c23)C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClCCl,488.0
Cc1ccc(C2(c3ccc(C)cc3)c3cccc4c3N3c5c2cccc5C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(C=Cc5ccc(C=C(C#N)C(=O)O)s5)cc(c23)C4(c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClCCl,507.0
Cc1ccc(C2=C(/C=C/C(=O)OC3CC[C@@]4(C)C(=CC[C@@H]5[C@@H]4CC[C@@]4(C)[C@H]5CC[C@@H]4[C@H](C)CCCC(C)C)C3)C(c3ccc(C)cc3)=[N+]3C2=Nc2c(-c4ccc(C)cc4)c(Br)c(-c4ccc(C)cc4)n2[B-]3(F)F)cc1,ClC(Cl)Cl,662.0
Cc1ccc(C2=C(c3ccc(C)cc3)C3=Cc4ccccc4NB3OB3Nc4ccccc4C=C32)cc1,ClCCl,412.0
Cc1ccc(C2=C(c3ccc(C)cc3)c3ccccc3B3Nc4ccccc4C=C32)cc1,ClCCl,384.0
Cc1ccc(C2=C3C=C(I)C(I)=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,C1CCCCC1,581.0
Cc1ccc(C2=C3C=C(I)C(I)=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CC#N,571.0
Cc1ccc(C2=C3C=C(I)C(I)=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CCO,577.0
Cc1ccc(C2=C3C=C(I)C(I)=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CCOC(C)=O,573.5
Cc1ccc(C2=C3C=C(I)C(I)=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CO,574.5
Cc1ccc(C2=C3C=C(I)C(I)=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,OCC(F)(F)F,569.0
Cc1ccc(C2=C3C=C(I)C=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,C1CCCCC1,563.5
Cc1ccc(C2=C3C=C(I)C=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CC#N,553.0
Cc1ccc(C2=C3C=C(I)C=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CCO,559.0
Cc1ccc(C2=C3C=C(I)C=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CCOC(C)=O,556.5
Cc1ccc(C2=C3C=C(I)C=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,CO,557.5
Cc1ccc(C2=C3C=C(I)C=[N+]3[B-](F)(F)n3c2cc(I)c3I)cc1,OCC(F)(F)F,553.0
Cc1ccc(C2=C3C=C4C(=[N+]3[B-](F)(F)n3c2cc2c3-c3ccccc3C23c2ccccc2-c2ccccc23)c2ccccc2C42c3ccccc3-c3ccccc32)cc1,C1CCOC1,634.0
Cc1ccc(C2=C3C=CC(/C=C/c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCCCC1,569.0
Cc1ccc(C2=C3C=CC(/C=C/c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCOC1,568.0
Cc1ccc(C2=C3C=CC(/C=C/c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1COCCO1,569.0
Cc1ccc(C2=C3C=CC(/C=C/c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CCOC(C)=O,565.0
Cc1ccc(C2=C3C=CC(/C=C/c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CO,564.0
Cc1ccc(C2=C3C=CC(/C=C/c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,Cc1ccccc1,572.0
Cc1ccc(C2=C3C=CC(/C=C/c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,ClC(Cl)Cl,571.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,C1CCCCC1,615.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,C1CCOC1,610.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,C1COCCO1,612.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,CCOC(C)=O,607.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,CO,605.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,Cc1ccccc1,614.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,ClC(Cl)Cl,614.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(C#Cc4ccccc4)ccc32)cc1,ClCCl,614.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCCCC1,564.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCOC1,560.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1COCCO1,562.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CCOC(C)=O,558.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CO,556.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,Cc1ccccc1,566.0
Cc1ccc(C2=C3C=CC(C#Cc4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,ClC(Cl)Cl,564.0
Cc1ccc(C2=C3C=CC(Cl)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCCCC1,514.0
Cc1ccc(C2=C3C=CC(Cl)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCOC1,511.0
Cc1ccc(C2=C3C=CC(Cl)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CC#N,508.0
Cc1ccc(C2=C3C=CC(Cl)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CCOC(C)=O,509.0
Cc1ccc(C2=C3C=CC(Cl)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CO,508.0
Cc1ccc(C2=C3C=CC(Cl)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,Cc1ccccc1,516.0
Cc1ccc(C2=C3C=CC(Cl)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,ClC(Cl)Cl,515.0
Cc1ccc(C2=C3C=CC(N4CCC(N5CCCCC5)CC4)=[N+]3[B-](F)(F)n3cccc32)cc1,ClCCl,481.0
Cc1ccc(C2=C3C=CC(N4CCCC4)=[N+]3[B-](F)(F)n3cccc32)cc1,ClCCl,473.0
Cc1ccc(C2=C3C=CC(N4CCOCC4)=[N+]3[B-](F)(F)n3c2ccc3-n2cccn2)cc1,ClCCl,502.0
Cc1ccc(C2=C3C=CC(N4CCOCC4)=[N+]3[B-](F)(F)n3c2ccc3-n2cnc3ccccc32)cc1,ClCCl,484.0
Cc1ccc(C2=C3C=CC(N4CCOCC4)=[N+]3[B-](F)(F)n3c2ccc3N2CCOCC2)cc1,ClCCl,570.0
Cc1ccc(C2=C3C=CC(Nc4ccccc4)=[N+]3[B-](F)(F)n3c(Nc4ccccc4)ccc32)cc1,CO,588.0
Cc1ccc(C2=C3C=CC(Sc4ccccc4)=[N+]3[B-](F)(F)n3c(Sc4ccccc4)ccc32)cc1,C1CCOC1,577.0
Cc1ccc(C2=C3C=CC([Se]c4ccccc4)=[N+]3[B-](F)(F)n3c([Se]c4ccccc4)ccc32)cc1,C1CCOC1,586.0
Cc1ccc(C2=C3C=CC([Te]c4ccccc4)=[N+]3[B-](F)(F)n3c([Te]c4ccccc4)ccc32)cc1,C1CCOC1,620.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCCCC1,530.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1CCOC1,530.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,C1COCCO1,531.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CCOC(C)=O,527.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,CO,525.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,Cc1ccccc1,534.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c(Cl)ccc32)cc1,ClC(Cl)Cl,532.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)cc1,C1CCCCC1,553.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)cc1,C1CCOC1,553.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)cc1,C1COCCO1,552.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)cc1,CCOC(C)=O,549.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)cc1,CO,547.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)cc1,Cc1ccccc1,557.0
Cc1ccc(C2=C3C=CC(c4ccccc4)=[N+]3[B-](F)(F)n3c2ccc3-c2ccccc2)cc1,ClC(Cl)Cl,554.0
Cc1ccc(C2=C3C=CC(n4c5ccccc5c5ccccc54)=[N+]3[B-](F)(F)n3c2ccc3-n2c3ccccc3c3ccccc32)cc1,ClCCl,564.0
Cc1ccc(C2=C3C=CC(n4cc(-c5ccccc5)cn4)=[N+]3[B-](F)(F)n3c2ccc3-n2cc(-c3ccccc3)cn2)cc1,ClCCl,584.0
Cc1ccc(C2=C3C=CC(n4cc(Cl)cn4)=[N+]3[B-](F)(F)n3c2ccc3-n2cc(Cl)cn2)cc1,ClCCl,562.0
Cc1ccc(C2=C3C=CC(n4cc(I)cn4)=[N+]3[B-](F)(F)n3c2ccc3-n2cc(I)cn2)cc1,ClCCl,565.0
Cc1ccc(C2=C3C=CC(n4cccn4)=[N+]3[B-](F)(F)n3c2cc(Br)c3-n2cccn2)cc1,ClCCl,540.0
Cc1ccc(C2=C3C=CC(n4cccn4)=[N+]3[B-](F)(F)n3c2ccc3-n2cccn2)cc1,ClCCl,559.0
Cc1ccc(C2=C3C=CC(n4cccn4)=[N+]3[B-](F)(F)n3c2ccc3N2CCOCC2)cc1,ClCCl,502.0
Cc1ccc(C2=C3C=CC(n4cnc5ccccc54)=[N+]3[B-](F)(F)n3c2ccc3N2CCOCC2)cc1,ClCCl,484.0
Cc1ccc(C2=C3C=CC(n4cncn4)=[N+]3[B-](F)(F)n3c2ccc3-n2cncn2)cc1,ClCCl,540.0
Cc1ccc(C2=C3C=CC(n4ncc5ccccc54)=[N+]3[B-](F)(F)n3c2ccc3-n2ncc3ccccc32)cc1,ClCCl,546.0
Cc1ccc(C2=C3C=CC4=[N+]3[B-](F)(F)n3c2ccc3-c2ccc([nH]2)/C(c2ccc(C)cc2)=c2/cc/c(o2)=C(\c2ccc(C)cc2)c2ccc4[nH]2)cc1,ClC(Cl)Cl,703.0
Cc1ccc(C2=C3C=CC4=[N+]3[P-](=O)(=O)n3c2ccc3-c2ccc([nH]2)/C(c2ccc(C)cc2)=c2/cc/c(o2)=C(\c2ccc(C)cc2)c2ccc4[nH]2)cc1,ClC(Cl)Cl,708.0
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3c2ccc3N(C)Cc2ccccc2)cc1,ClCCl,489.0
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3c2ccc3N(Cc2ccccc2)Cc2ccccc2)cc1,ClCCl,501.0
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,C1CCCCC1,500.5
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,CC#N,496.5
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,CCO,497.5
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,CCOC(C)=O,497.0
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,CO,496.0
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,ClCCl,499.0
Cc1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3cccc32)cc1,OCC(F)(F)F,493.0
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,C1CCCCC1,584.5
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,C1CCOC1,581.5
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CC#N,578.0
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CCOC(C)=O,579.5
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CN(C)C=O,581.5
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CO,578.0
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,Cc1ccccc1,588.0
Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,ClCCl,583.5
Cc1ccc(C2=CC(c3ccc(C)cc3)=[N+]3C2=Nc2c(-c4ccc(C)cc4)cc(-c4ccc(C)cc4)n2[B-]3(F)F)cc1,ClC(Cl)Cl,652.0
Cc1ccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,437.0
Cc1ccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)cc1,ClC(Cl)Cl,404.0
Cc1ccc(C2=Nc3cccc4[n+]3[B-](F)(O2)OC(c2ccc(C)cc2)=N4)cc1,ClCCl,394.0
Cc1ccc(C2=Nc3cccc4[n+]3[B-](c3ccccc3)(N2)NC(c2ccc(C)cc2)=N4)cc1,ClCCl,435.0
Cc1ccc(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,C1CCOC1,607.0
Cc1ccc(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CC#N,600.0
Cc1ccc(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CCCCCC,607.0
Cc1ccc(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CO,602.0
Cc1ccc(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,Cc1ccccc1,612.0
Cc1ccc(C2=[N+]3C(=Cc4c(C)cc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,ClCCl,608.0
Cc1ccc(C2=[N+]3C(=Cc4ccc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,C1CCOC1,599.0
Cc1ccc(C2=[N+]3C(=Cc4ccc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CC#N,592.0
Cc1ccc(C2=[N+]3C(=Cc4ccc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CCCCCC,602.0
Cc1ccc(C2=[N+]3C(=Cc4ccc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,CO,595.0
Cc1ccc(C2=[N+]3C(=Cc4ccc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,Cc1ccccc1,606.0
Cc1ccc(C2=[N+]3C(=Cc4ccc(C)n4[B-]3(F)F)c3ccccc32)[nH]1,ClCCl,600.0
Cc1ccc(C2=[N+]3C(=Nc4c5ccccc5c(-c5ccc(C)s5)n4[B-]3(F)F)c3ccccc32)s1,ClCCl,793.0
Cc1ccc(C2C(C#N)=C(N)n3c(=O)c4ccccc4c(=O)n32)cc1,CS(C)=O,351.0
Cc1ccc(C2C3=C(CC(C)(C)CC3=O)Oc3ccc4ccc(OCCCNCCCNc5ccnc6cc(Cl)ccc56)cc4c32)cc1,CO,331.0
Cc1ccc(C2C3=C(CC(C)(C)CC3=O)Oc3ccc4ccc(OCCCNCCNc5ccnc6cc(Cl)ccc56)cc4c32)cc1,CO,330.0
Cc1ccc(C2C3=C(CCCC3=O)Nc3c2c(=O)oc2ccccc32)cc1,CS(C)=O,366.0
Cc1ccc(C2CC(=O)Oc3c2c2nc4ccc(C)cc4nc2c2ccccc32)cc1,ClC(Cl)Cl,411.0
Cc1ccc(C2CC(=O)Oc3c2c2nc4ccccc4nc2c2ccccc32)cc1,ClC(Cl)Cl,410.0
Cc1ccc(C2NC(=O)c3ccccc3N2)o1,ClC(Cl)Cl,329.8
Cc1ccc(C=C(C#N)c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)cc2)cc1,C1CCOC1,401.0
Cc1ccc(C=C(C#N)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,398.0
Cc1ccc(C=CC(=O)c2nnn(-c3ccnc4cc(Cl)ccc34)c2C)cc1,CO,234.0
Cc1ccc(C=NCCN=Cc2ccc(C)cc2)cc1,ClCCl,246.0
Cc1ccc(CN(Cc2ccc(C)cc2)c2nc(C#N)c(N(Cc3ccc(C)cc3)Cc3ccc(C)cc3)nc2C#N)cc1,ClC(Cl)Cl,496.0
Cc1ccc(CN2/C(=C/C=C3\CCCC(/C=C/C4=[N+](Cc5ccc(C)cc5)c5ccccc5C4(C)C)=C3Cl)C(C)(C)c3ccccc32)cc1,CO,785.0
Cc1ccc(CN[C@@H]2C[C@H]2NCc2ccc(C)o2)o1,CCO,317.0
Cc1ccc(Cl)c(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)c1F,CS(C)=O,431.0
Cc1ccc(F)c(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)c1Cl,CS(C)=O,431.0
Cc1ccc(F)cc1C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,431.0
Cc1ccc(N(/C2=C3\C=CC(=N3)/C(N(c3ccc(C)cc3)c3ccc(C)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2ccc(C(=O)O)cc2)c2ccc(C)cc2)cc1,ClCCl,636.0
Cc1ccc(N(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2c(C)cc(C)cc2C)=C2/C=CC(=N2)/C=4N(c2ccc(C)cc2)c2ccc(C)cc2)c2ccc(C)cc2)cc1,ClCCl,636.0
Cc1ccc(N(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3c(C)cc(C)cc3C)=C3/C=CC2=N3)/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2c(C)cc(C)cc2C)c2ccc(C)cc2)cc1,ClCCl,615.0
Cc1ccc(N(C)C)cc1C1=C2C=CC(=[N+](C)C)C=C2[Si](C)(C)c2cc(N(C)C)ccc21,O,646.0
Cc1ccc(N(CC(=O)O)CC(=O)O)c(OCCOc2cc(-c3c4cc(Cl)c(=O)cc-4oc4cc(O)c(Cl)cc34)ccc2N(CC(=O)O)CC(=O)O)c1,O,506.0
Cc1ccc(N(CC(=O)O)CC(=O)O)c(OCCOc2cc(-c3c4cc(F)c(=O)cc-4oc4cc(O)c(F)cc34)ccc2N(CC(=O)O)CC(=O)O)c1,O,494.0
Cc1ccc(N(CC(=O)[O-])CC(=O)[O-])c(OCCOc2cc3cc(-c4ncc(C(=O)[O-])o4)oc3cc2N(CC(=O)[O-])CC(=O)[O-])c1,O,362.0
Cc1ccc(N(c2cc(C(C)(C)C)ccc2C)c2ccc3ccc4c(N(c5ccc(C)cc5C)c5cc(C(C)(C)C)ccc5C)ccc5ccc2c3c54)c(C)c1,Cc1ccccc1,431.0
Cc1ccc(N(c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)cc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)cc2)c(C)c1,ClC(Cl)Cl,456.0
Cc1ccc(N(c2ccc(/C=C/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2cc(C)c3c(c2)CN2CN3Cc3cc(N(c4ccc(/C=C/C=C5\SC(=S)N(CC(=O)O)C5=O)cc4)c4ccc(C)c(C)c4)cc(C)c32)cc1C,CS(C)=O,510.0
Cc1ccc(N(c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2cc(C)c3c(c2)CN2CN3Cc3cc(N(c4ccc(/C=C5\SC(=S)N(CC(=O)O)C5=O)cc4)c4ccc(C)c(C)c4)cc(C)c32)cc1C,CS(C)=O,475.0
Cc1ccc(N(c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2ccc(/C=N/N(c3ccccc3)c3ccccc3)cc2)cc1,ClC(Cl)Cl,495.0
Cc1ccc(N(c2ccc(/C=C\C=C\C=C3/SC(=S)N(CC(=O)O)C3=O)cc2)c2cc(C)c3c(c2)CN2CN3Cc3cc(N(c4ccc(/C=C\C=C\C=C5/SC(=S)N(CC(=O)O)C5=O)cc4)c4ccc(C)c(C)c4)cc(C)c32)cc1C,CS(C)=O,526.0
Cc1ccc(N(c2ccc(C)cc2)c2c([O-])c(=[N+](c3ccc(C)cc3)c3ccc(C)cc3)c2=O)cc1,CN(C)C=O,415.0
Cc1ccc(N(c2ccc(C)cc2)c2cc(N(c3ccc(C)cc3)c3ccc(C)cc3)c3ccc4c(N(c5ccc(C)cc5)c5ccc(C)cc5)cc(N(c5ccc(C)cc5)c5ccc(C)cc5)c5ccc2c3c54)cc1,C1CCOC1,476.0
Cc1ccc(N(c2ccc(C)cc2)c2cc(N(c3ccc(C)cc3)c3ccc(C)cc3)c3ccc4cc(C(C)(C)C)cc5ccc2c3c54)cc1,ClCCl,424.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4)c4nsnc34)cc2)cc1,Cc1ccccc1,538.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3c4ccccc4c(-c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4)c4nsnc34)cc2)cc1,ClCCl,536.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3cc4c(cc(-c5ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc5)c5nsnc54)c4nsnc34)cc2)cc1,Cc1ccccc1,520.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3cc4c(cc(-c5ccc(N(c6ccc(C)cc6)c6ccc(C)cc6)cc5)c5nsnc54)c4nsnc34)cc2)cc1,ClCCl,518.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)s2)cc1,C1CCOC1,488.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)c5ccc(C(=O)O)cc5)s4)s3)cc2)cc1,ClC(Cl)Cl,475.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)c5ccc(C(=O)O)cc5)s4)s3)s2)cc1,ClC(Cl)Cl,495.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)cc4)s3)cc2)cc1,C1CCOC1,445.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3)cc2)cc1,C1CCOC1,430.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4)c4nsnc34)cc2)cc1,Cc1ccccc1,474.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccc(N(c5ccc(C)cc5)c5ccc(C)cc5)cc4)c4nsnc34)cc2)cc1,ClCCl,485.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(-c4ccncc4)c4nsnc34)cc2)cc1,ClCCl,461.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(C=C(C#N)C#N)cc3)cc2)cc1,ClC(Cl)Cl,477.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(C=C(C#N)C#N)o3)cc2)cc1,ClC(Cl)Cl,521.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc(C=C(C#N)C#N)s3)cc2)cc1,ClC(Cl)Cl,521.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3cc(-c5ccc(-c6ccc(/C=C(\C#N)C(=O)O)s6)s5)ccc3-4)cc2)cc1,C1CCOC1,393.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,C1CCOC1,463.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,CCCCCC,457.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,CCOC(C)=O,461.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,CCOCC,459.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,Cc1ccccc1,470.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,ClC(Cl)(Cl)Cl,474.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,ClCCl,476.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3ncc(-c4ccc(C#N)nc4)c4nsnc34)cc2)cc1,ClCCl,519.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CC#N,404.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CCCCCC,404.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-c3nnc(-c4ccc(C=C(C#N)C(=O)O)cc4)o3)cc2)cc1,CO,404.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(-n3ccc4cc(-c5cc(C)c(/C=C(\C#N)C(=O)O)s5)ccc43)cc2)cc1,ClC(Cl)Cl,430.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/c3ccc(/C=C(/C#N)C(=O)O)cc3)cc2)cc1,C1CCOC1,437.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/c3ccc(/C=C(\C#N)C(=O)O)cc3)cc2)cc1,ClCCl,463.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/c3ccc(Nc4ncc(/C=C(\C#N)C(=O)O)cn4)cc3)cc2)cc1,ClCCl,380.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/c3ccc(Nc4ncc(/C=C(\C#N)C(=O)O)cn4)cc3C#N)cc2)cc1,Cc1ccccc1,419.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=C/c3sc(-c4sc(/C=C(\C#N)C(=O)O)c5c4OCCO5)c4c3OCCO4)cc2)cc1,CN(C)C=O,478.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(/C=N/N(c3ccccc3)c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)cc3)cc2)cc1,ClC(Cl)Cl,495.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(C3=Cc4ccc(/C=C(/C#N)C(=O)O)cc4C3)cc2)cc1,C1CCOC1,447.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=Cc3cc4sc(C=C(C#N)C(=O)O)cc4s3)cc2)cc1,CN(C)C=O,443.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=Cc3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)s3)cc2)cc1,CN(C)C=O,457.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=Cc3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1,CN(C)C=O,437.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=Cc3ccc(/C=C/c4ccc(C=C(C#N)C(=O)O)s4)s3)cc2)cc1,CN(C)C=O,473.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(C=Cc3sc(C=C(C#N)C(=O)O)c4c3OCCO4)cc2)cc1,CN(C)C=O,460.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(N3c4ccc(-c5ccc(N(c6ccccc6)c6cccc7ccccc67)cc5)cc4Sc4cc(-c5ccc(/C=C(\C#N)C(=O)O)s5)ccc43)cc2)cc1,C1CCOC1,480.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(N3c4ccc(/C=C(\C#N)C(=O)O)cc4Sc4cc(-c5ccc(-c6ccc(N(c7ccccc7)c7cccc8ccccc78)cc6)s5)ccc43)cc2)cc1,C1CCOC1,472.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc(Oc3nnc(Cl)nn3)cc2)cc1,ClCCl,523.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c4c(F)c(F)c(-c5ccc(C(=O)O)cc5)c5nsnc45)sc2-3)cc1,ClC(Cl)Cl,525.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c4ccc(-c5ccc(-c6ccc(C(=O)O)cc6)c6nsnc56)s4)sc2-3)cc1,ClC(Cl)Cl,520.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c(c2)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2cc(-c4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)sc2-3)cc1,ClC(Cl)Cl,532.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c4cccc5c(N(c6ccc(C)cc6)c6ccc(C)cc6)ccc(c6cccc2c63)c54)cc1,C1CCCCC1,506.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c4cccc5c(N(c6ccc(C)cc6)c6ccc(C)cc6)ccc(c6cccc2c63)c54)cc1,C1CCOC1,502.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c4cccc5c(N(c6ccc(C)cc6)c6ccc(C)cc6)ccc(c6cccc2c63)c54)cc1,CC#N,496.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c4cccc5c(N(c6ccc(C)cc6)c6ccc(C)cc6)ccc(c6cccc2c63)c54)cc1,Cc1ccccc1,507.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3c4cccc5c(N(c6ccc(C)cc6)c6ccc(C)cc6)ccc(c6cccc2c63)c54)cc1,ClCCl,473.0
Cc1ccc(N(c2ccc(C)cc2)c2ccc3ccc4cccc5ccc2c3c45)cc1,ClCCl,412.0
Cc1ccc(N(c2ccc(C=NN(c3ccccc3)c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)cc2)c2ccc(C=NN(c3ccccc3)c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)cc2)cc1,ClC(Cl)Cl,484.0
Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)s3)cc2)cc1,C1CCOC1,479.0
Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(/C=C/c5cc6sc(/C=C(\C#N)C(=O)O)cc6s5)cc4)c4ccc(C)cc4C)cc3)cc2)c(C)c1,C1CCOC1,487.0
Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(/C=C/c5ccc(/C=C(\C#N)C(=O)O)s5)cc4)c4ccc(C)cc4C)cc3)cc2)c(C)c1,C1CCOC1,489.0
Cc1ccc(N(c2ccccc2)c2ccc(-c3ccc(N(c4ccc(/C=C/c5sc(/C=C(/C#N)C(=O)O)c6c5OCCO6)cc4)c4ccc(C)cc4C)cc3)cc2)c(C)c1,C1CCOC1,511.0
Cc1ccc(N(c2ccccc2)c2ccc(C=NN(c3ccccc3)c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)cc2)cc1,ClC(Cl)Cl,488.0
Cc1ccc(N/C=C/C=[NH+]c2ccc(C)cc2)cc1,CS(C)=O,376.0
Cc1ccc(N2C(c3ccccc3N(C)C)=NC(c3ccccc3)C2c2ccccc2)cc1,Cc1ccccc1,275.0
Cc1ccc(N2C(c3ccccc3N)=NC(c3ccccc3)C2c2ccccc2)cc1,Cc1ccccc1,282.0
Cc1ccc(N2C(c3ccccc3[NH-])=[NH+]C(c3ccccc3)C2c2ccccc2)cc1,Cc1ccccc1,328.0
Cc1ccc(N2c3cc(-c4ccc(-c5cc6c(s5)-c5sc(C=C(C#N)C(=O)O)cc5-c5c7cccc5OCCCCCCCCOc5cccc(c5-6)OCCCCCCCCO7)c5nsnc45)ccc3C3CCCC32)cc1,ClCCl,544.0
Cc1ccc(N2c3cc(-c4ccc(-c5ccc(-c6ccc(/C=C(/C#N)C(=O)O)s6)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)ccc3C3CCCC32)cc1,ClCCl,527.0
Cc1ccc(N2c3cc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)ccc3C3CCCC32)cc1,ClCCl,529.0
Cc1ccc(N2c3cc(-c4ccc(C=C5C(=O)NC(=S)NC5=O)s4)ccc3C3CCCC32)cc1,ClCCl,615.0
Cc1ccc(N2c3ccc(-c4cc5sc6cc(C=C(C#N)C(=O)O)sc6c5s4)cc3C3CCCC32)cc1,C1COCCO1,481.0
Cc1ccc(N2c3ccc(-c4cc5sc6cc(C=C(C#N)C(=O)O)sc6c5s4)cc3C3CCCC32)cc1,CCO,481.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)cc3[C@H]3CCC[C@H]32)cc1,ClCCl,531.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(/C#N)C(=O)O)s5)c5nsnc45)cc3C3CCCC32)cc1,ClCCl,548.6666666666666
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)c5nc(-c6ccc(C)s6)c(-c6ccc(C)s6)nc45)cc3C3CCCC32)cc1,ClCCl,410.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)c5nc(-c6ccc(C)s6)c(-c6ccc(C)s6)nc45)cc3[C@H]3CCC[C@H]32)cc1,ClCCl,475.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)c5nccnc45)cc3C3CCCC32)cc1,ClCCl,442.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)cc5)c5nsnc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,496.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc(-c6ccc(C)s6)c(-c6ccc(C)s6)nc45)cc3C3CCCC32)cc1,ClCCl,418.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc(-c6ccc(C)s6)c(-c6ccc(C)s6)nc45)cc3[C@H]3CCC[C@H]32)cc1,ClCCl,530.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,526.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc6c7ccccc7c7ccccc7c6nc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,546.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nc6c7ccccc7c7ccccc7c6nc45)cc3[C@H]3CCC[C@H]32)cc1,ClCCl,546.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nccnc45)cc3C3CCCC32)cc1,ClCCl,411.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nccnc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,481.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nn(C)nc45)cc3C3CCCC32)cc1,ClCCl,495.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)cc3C3CCCC32)cc1,ClCCl,545.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3C3CCCC32)cc1,ClCCl,518.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C(=O)O)cc5)c5nonc45)cc3C3CCCC32)cc1,ClCCl,501.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)cc3C3CCCC32)cc1,ClCCl,484.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,484.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)c5nc(-c6ccc(C)s6)c(-c6ccc(C)s6)nc45)cc3C3CCCC32)cc1,ClCCl,475.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)c5nccnc45)cc3C3CCCC32)cc1,ClCCl,442.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)cc5)c5nonc45)cc3C3CCCC32)cc1,ClCCl,519.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nc(-c6ccc(C)s6)c(-c6ccc(C)s6)nc45)cc3C3CCCC32)cc1,ClCCl,530.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)cc3C3CCCC32)cc1,ClCCl,529.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nccnc45)cc3C3CCCC32)cc1,ClCCl,481.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)cc3C3CCCC32)cc1,ClCCl,545.0
Cc1ccc(N2c3ccc(-c4ccc(-c5ccc(C=C(C#N)C(=O)O)s5)s4)cc3C3CCCC32)cc1,ClCCl,518.0
Cc1ccc(N2c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3[C@@H]3CCC[C@H]32)cc1,C1CCOC1,492.0
Cc1ccc(N2c3ccc(-c4ccc(/C=C/c5ccc(/C=C(\C#N)C(=O)O)s5)s4)cc3[C@@H]3CCC[C@H]32)cc1,C1CCOC1,518.0
Cc1ccc(N2c3ccc(-c4ccc(/C=C/c5ccc(C=C(C#N)C(=O)O)s5)s4)cc3[C@@H]3CCC[C@H]32)cc1,C1CCOC1,518.0
Cc1ccc(N2c3ccc(-c4ccc(/C=C5/SC(N)=NC5=O)s4)cc3C3CCCC32)cc1,ClCCl,461.0
Cc1ccc(N2c3ccc(-c4ccc(C#Cc5ccc(C(=O)O)cc5)c5nsnc45)cc3C3CCCC32)cc1,ClCCl,508.0
Cc1ccc(N2c3ccc(-c4ccc(C#Cc5ccc(C(=O)O)cc5)c5nsnc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,508.0
Cc1ccc(N2c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3C3CCCC32)cc1,ClCCl,483.0
Cc1ccc(N2c3ccc(-c4ncc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5nsnc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClC(Cl)Cl,576.0
Cc1ccc(N2c3ccc(-c4ncc(-c5ccc(C=C(C#N)C(=O)O)s5)c5nsnc45)cc3C3CCCC32)cc1,ClC(Cl)Cl,576.0
Cc1ccc(N2c3ccc(-c4ncc(C5=CC=C(/C=C(/C#N)C(=O)O)C5)c5nc(-c6ccccc6)c(-c6ccccc6)nc45)cc3C3CCCC32)cc1,ClCCl,563.0
Cc1ccc(N2c3ccc(-c4sc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5c4OCCO5)cc3C3CCCC32)cc1,C1CCOC1,518.0
Cc1ccc(N2c3ccc(-c4sc(-c5ccc(/C=C(\C#N)C(=O)O)s5)c5c4OCCO5)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,518.0
Cc1ccc(N2c3ccc(-c4sc(C=C(C#N)C(=O)O)c5c4OCCO5)cc3C3CCCC32)cc1,ClCCl,523.0
Cc1ccc(N2c3ccc(/C4=C5\C=CC(=N5)/C(c5cc(C(C)(C)C)cc(C(C)(C)C)c5)=c5/cc/c6n5[Zn]n5c(ccc54)/C(c4cc(C(C)(C)C)cc(C(C)(C)C)c4)=C4/C=CC(=N4)/C=6C#Cc4ccc(C(=O)O)cc4)cc3C3CCCC32)cc1,C1CCOC1,630.0
Cc1ccc(N2c3ccc(/C=C(\C#N)C(=O)O)cc3[C@@H]3CCC[C@H]32)cc1,C1CCOC1,438.0
Cc1ccc(N2c3ccc(/C=C/C4=C/C(=C(\C#N)C(=O)O)CC(C)(C)C4)cc3C3CCCC32)cc1,CC#N,497.0
Cc1ccc(N2c3ccc(/C=C/c4ccc(/C=C(\C#N)C(=O)O)s4)cc3[C@@H]3CCC[C@H]32)cc1,C1CCOC1,504.0
Cc1ccc(N2c3ccc(/C=C/c4ccc(C=C(C#N)C(=O)O)s4)cc3[C@@H]3CCC[C@H]32)cc1,C1CCOC1,504.0
Cc1ccc(N2c3ccc(/C=C/c4ccc(Nc5ncc(/C=C(\C#N)C(=O)O)cn5)c5nn(C)nc45)cc3C3CCCC32)cc1,Cc1ccccc1,453.0
Cc1ccc(N2c3ccc(/C=C/c4ccc(Nc5ncc(/C=C(\C#N)C(=O)O)cn5)cc4)cc3C3CCCC32)cc1,ClCCl,388.0
Cc1ccc(N2c3ccc(/C=C/c4ccc(Nc5ncc(/C=C(\C#N)C(=O)O)cn5)cc4C#N)cc3C3CCCC32)cc1,Cc1ccccc1,434.0
Cc1ccc(N2c3ccc(C#Cc4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)cc3C3CCCC32)cc1,ClCCl,482.0
Cc1ccc(N2c3ccc(C#Cc4ccc(-c5ccc(C(=O)O)cc5)c5nsnc45)cc3[C@@H]3CCC[C@@H]32)cc1,ClCCl,482.0
Cc1ccc(N2c3ccc(C=Cc4ccc(C=C(C#N)C(=O)O)s4)cc3C3CCCC32)cc1,ClCCl,529.0
Cc1ccc(N=Nc2c(-c3ccccc3)[nH]c3c(N=Nc4ccccc4)c(C)nn23)cc1,C1COCCO1,524.0
Cc1ccc(N=Nc2c(-c3ccccc3)[nH]c3ccccc23)cc1,CS(C)=O,401.0
Cc1ccc(N=Nc2c(N)n3c(nc4ccccc43)[nH]c2=O)cc1,ClC(Cl)Cl,422.0
Cc1ccc(N=Nc2ccc(O)c3ncccc23)cc1,CS(C)=O,397.0
Cc1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,C1CCCCC1,306.0
Cc1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,C1CCOC1,311.0
Cc1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,CC#N,312.0
Cc1ccc(NC(=O)c2ccc(N(C)C)cc2)cc1,CCOCC,307.0
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,C1CCOC1,301.5
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,CC#N,281.6
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,CCCCCC,286.9
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,CCOC(C)=O,286.1
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,CN(C)C=O,287.1
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,CO,282.1
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,CS(C)=O,283.5
Cc1ccc(NC(=O)c2sc(Br)nc2C)cc1,ClC(Cl)Cl,288.3
Cc1ccc(N[C@@H](C2=C(O)C(=O)c3ccccc3C2=O)c2ccc(Br)cc2)cc1,CCO,454.0
Cc1ccc(N[C@@H](C2=C(O)C(=O)c3ccccc3C2=O)c2ccc(C)cc2)cc1,CCO,444.0
Cc1ccc(N[C@@H](C2=C(O)C(=O)c3ccccc3C2=O)c2ccc(Cl)cc2Cl)cc1,CCO,455.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,C1CCCCC1,639.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,C1COCCO1,638.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CC(C)=O,638.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CCCCCCCCCCO,644.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CCCCCCCO,641.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CCCCCCO,642.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CCCCO,639.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CCO,637.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CN(C)C=O,643.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CO,636.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,CS(C)=O,644.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,ClC(Cl)(Cl)Cl,642.0
Cc1ccc(Nc2ccc(Nc3ccc(C)cc3)c3c2C(=O)c2ccccc2C3=O)cc1,c1ccccc1,642.0
Cc1ccc(Nc2ccc3ccccc3n2)cc1,CCO,355.0
Cc1ccc(Nc2ccc3ccccc3n2)cc1,CCOC(C)=O,353.0
Cc1ccc(Nc2ccc3ccccc3n2)cc1,Cc1ccccc1,350.0
Cc1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,CC#N,394.0
Cc1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,CO,399.0
Cc1ccc(O)c(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1,ClCCl,393.0
Cc1ccc(O)c(-c2nc(C)c3n2CCCC3)c1,ClCCl,321.0
Cc1ccc(O)c(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1,CS(C)=O,564.0
Cc1ccc(O)c(C(=O)[O-])c1,CO,321.0
Cc1ccc(O)c(C(=O)[O-])c1,O,305.0
Cc1ccc(O)cc1,O,276.0
Cc1ccc(OCc2cc(=O)oc3c2ccc2ccccc23)cc1,C1CCOC1,352.0
Cc1ccc(OCc2cc(=O)oc3c2ccc2ccccc23)cc1,C1COCCO1,352.0
Cc1ccc(OCc2cc(=O)oc3c2ccc2ccccc23)cc1,CCOC(C)=O,351.0
Cc1ccc(OCc2cc(=O)oc3c2ccc2ccccc23)cc1,CO,352.0
Cc1ccc(OCc2cc(=O)oc3c2ccc2ccccc23)cc1,Cc1ccccc1,354.0
Cc1ccc(OCc2cc(=O)oc3c2ccc2ccccc23)cc1,ClCCl,354.0
Cc1ccc(OCc2nnc(-c3cc(-c4ccc(Cl)cc4)nn3Cc3ccc(C(C)(C)C)cc3)o2)cc1,ClCCl,260.0
Cc1ccc(OCc2nnc(-c3cc(-c4ccc(Cl)cc4)nn3Cc3ccc(Cl)nc3)o2)cc1,ClCCl,260.0
Cc1ccc(OCc2nnc(-c3ccn4c(C)nc(Cl)c4c3)o2)cc1,CC#N,361.0
Cc1ccc(Oc2ccc(/C=C/c3cc(C)c4n3[B-](F)(F)[N+]3=CC=CC3=C4)cc2)cc1,CS(C)=O,561.0
Cc1ccc(S(=O)(=O)/N=C/C2=Cc3c(-c4ccccc4)oc(-c4ccccc4)c3C=C(/C=N/S(=O)(=O)c3ccc(C)cc3)C2)cc1,ClC(Cl)Cl,408.0
Cc1ccc(S(=O)(=O)/N=c2/cc3cc(C)ccc3cn2-c2ccccc2)cc1,CC#N,427.0
Cc1ccc(S(=O)(=O)/N=c2/cc3cc(F)ccc3cn2-c2ccccc2)cc1,CC#N,424.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccc(Cl)cc3cn2-c2ccccc2)cc1,CC#N,443.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccc(F)cc3cn2-c2ccccc2)cc1,CC#N,443.0
Cc1ccc(S(=O)(=O)/N=c2/cc3cccc(F)c3cn2-c2ccccc2)cc1,CC#N,440.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(Br)cc2)cc1,CC#N,436.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(C)c(C)c2)cc1,CC#N,433.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(C)cc2C)cc1,CC#N,432.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(CCC(=O)O)cc2)cc1,CC#N,434.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(CCN=[N+]=[N-])cc2)cc1,CC#N,435.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(CCO)cc2)cc1,CC#N,434.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(Cl)cc2C)cc1,CC#N,434.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(F)cc2)cc1,CC#N,435.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccc(I)cc2)cc1,CC#N,435.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2cccc(Br)c2)cc1,CC#N,437.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2cccc(Cl)c2)cc1,CC#N,436.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2cccc(OCc3ccccc3)c2)cc1,CC#N,434.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2cccc3ccccc23)cc1,CC#N,434.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2-c2ccccn2)cc1,CC#N,437.0
Cc1ccc(S(=O)(=O)/N=c2/cc3ccccc3cn2Nc2ccccc2)cc1,CC#N,425.0
Cc1ccc(S(=O)(=O)/N=c2\oc3cccc4c5c(-c6ccccc6)oc6cccc(c(c2-c2ccccc2)c34)c65)cc1,ClC(Cl)Cl,445.0
Cc1ccc(S(=O)(=O)Nc2c(/C=C/c3ccccc3)sc(-c3ccc(N(C)C)cc3)c2-c2ccsc2)cc1,CC#N,465.0
Cc1ccc(S(=O)(=O)Nc2c(/C=C/c3ccccc3)sc(-c3ccc(N(C)C)s3)c2-c2cccnc2)cc1,CC#N,395.0
Cc1ccc(S(=O)(=O)Nc2cc(-c3ccc(N(C)C)cc3)sc2/C=C/c2ccccc2)cc1,CC#N,415.0
Cc1ccc(S(N)(=O)=O)cc1,CC#N,225.0
Cc1ccc(Sc2cc3ccc4cccc5ccc(c2)c3c45)cc1,ClCCl,342.0
Cc1ccc(Sc2ccc3ccc4cccc5ccc2c3c45)cc1,ClCCl,352.0
Cc1ccc([N+]2=c3c4n(c5ccccc35)[B-](F)(F)[N+](c3ccc(C)cc3)=c3c=4n(c4ccccc34)[B-]2(F)F)cc1,ClCCl,743.0
Cc1ccc2/c(=C/c3ccc(N(C)C)cc3)o/c(=C\c3ccccc3)c2c1,ClCCl,407.0
Cc1ccc2[nH]c(-c3ccc(-c4ccc(-c5ccc(-c6nc7cc(C)ccc7[nH]6)cc5)c(C)c4)cc3)nc2c1,CN(C)C=O,333.0
Cc1ccc2[nH]c(-c3ccc(-c4ccc(-c5ccc(-c6nc7cc(C)ccc7[nH]6)cc5)c(F)c4)cc3)nc2c1,CN(C)C=O,344.0
Cc1ccc2c(-c3cc(-c4cc5c(ccc6ccccc65)oc4=O)nc(-c4cc5c(ccc6ccccc65)oc4=O)c3)cc(=O)oc2c1,Clc1ccccc1,385.0
Cc1ccc2c(-c3cc(-c4cc5ccccc5oc4=O)nc(-c4cc5ccccc5oc4=O)c3)cc(=O)oc2c1,Clc1ccccc1,352.0
Cc1ccc2c(-c3ccc(Br)cc3)c3c(n2c1)C(=O)N(CCNC(=O)OC(C)(C)C)C3,ClCCl,312.0
Cc1ccc2c(-c3ccccc3)c(-c3ccccc3)c3cccc4c(-c5ccccc5)c(-c5ccccc5)c1[n+]2c34,ClCCl,355.0
Cc1ccc2c(C=Cc3ccc(N(C)c4ccccc4)cc3)cc(=O)oc2c1,ClC(Cl)Cl,424.0
Cc1ccc2c(C=Cc3ccc4c(c3)Sc3cc(C=Cc5cc(=O)oc6cc(C)ccc56)ccc3N4C)cc(=O)oc2c1,ClC(Cl)Cl,441.0
Cc1ccc2c(C=Cc3ccc4c(c3)c3ccccc3n4C)cc(=O)oc2c1,ClC(Cl)Cl,393.0
Cc1ccc2c(C=Cc3cn(C)c4ccccc34)cc(=O)oc2c1,ClC(Cl)Cl,398.0
Cc1ccc2c(CC(=O)NN)coc2c1,C1CCOC1,295.0
Cc1ccc2c(CC(=O)NN)coc2c1,CC#N,278.0
Cc1ccc2c(CC(=O)NN)coc2c1,CC(C)=O,298.0
Cc1ccc2c(CC(=O)NN)coc2c1,CCCCO,279.0
Cc1ccc2c(CC(=O)NN)coc2c1,CCCO,284.0
Cc1ccc2c(CC(=O)NN)coc2c1,CCO,288.0
Cc1ccc2c(CC(=O)NN)coc2c1,CCOC(C)=O,298.0
Cc1ccc2c(CC(=O)NN)coc2c1,CN(C)C=O,310.0
Cc1ccc2c(CC(=O)NN)coc2c1,CO,281.0
Cc1ccc2c(CC(=O)NN)coc2c1,ClCCl,291.0
Cc1ccc2c(c1)B(c1c(C(C)C)cc(C(C)C)cc1C(C)C)c1cc(C)cc3c1N2c1ccc(C)cc1B3c1c(C(C)C)cc(C(C)C)cc1C(C)C,ClCCl,457.0
Cc1ccc2c(c1)C(C)(C)c1cc(C)ccc1N2c1ccc2c(c1)C(C)(C)c1cc(N3c4ccc(C)cc4C(C)(C)c4cc(C)ccc43)ccc1S2(=O)=O,ClCCl,370.0
Cc1ccc2c(c1)C(c1ccccc1)=C(c1ccccc1)C1=Cc3ccccc3NB12,ClCCl,382.0
Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1,Cc1ccccc1,386.0
Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc(-c2ncccn2)cc1,Cc1ccccc1,380.0
Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc2c(c1)Oc1ccccc1P2(=O)c1ccccc1,Cc1ccccc1,311.2466125
Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc2c(c1)Oc1ccccc1P2(=S)c1ccccc1,Cc1ccccc1,311.2466125
Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc2c(c1)Sc1ccccc1P2(=O)c1ccccc1,Cc1ccccc1,311.2466125
Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(C)ccc1N2c1ccc2c(c1)Sc1ccccc1P2(=S)c1ccccc1,Cc1ccccc1,311.2466125
Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc(C)ccc1N2c1ccc(-c2nc(-c3ccccc3)cc(-c3ccccc3)n2)cc1,Cc1ccccc1,378.0
Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc(C)ccc1N2c1ccc(-c2ncccn2)cc1,Cc1ccccc1,379.0
Cc1ccc2c(c1)N(Cc1ccccc1)B1C(=C2)C(c2ccccc2)=C(c2ccccc2)c2ccccc21,ClCCl,394.0
Cc1ccc2c(c1)N(Cc1ccccc1)B1OB3C(=Cc4ccc(C)cc4N3Cc3ccccc3)C(c3ccccc3)=C(c3ccccc3)C1=C2,ClCCl,421.0
Cc1ccc2c(c1)c(=O)c1ccccc1n2CCCCCC(=O)O,O,419.0
Cc1ccc2c(c1)c(C#N)c(C#N)c1cc(C)ccc12,ClC(Cl)Cl,343.0
Cc1ccc2c(c1)c1cc(Br)ccc1n2-c1c(C#N)c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c(C#N)c1-n1c2ccc(Br)cc2c2cc(Br)ccc21,Cc1ccccc1,339.0
Cc1ccc2c(c1)c1ccc(C(C)(C)C)cc1n[n+]2-c1cccc(C(C)(C)C)c1,ClCCl,392.0
Cc1ccc2c(c1)n(C)c(-c1ccc(-c3ccc(-c4ccc(-c5n(C)c6cc(C)ccc6[n+]5C)cc4)cc3)cc1)[n+]2C,O,315.0
Cc1ccc2c(c1)nc1c(=O)n(C)c(=O)nc-1n2C,CC#N,446.0
Cc1ccc2c(c1)nnn2-c1c(C#N)c2c(N)ncnc2n1[C@H]1C[C@H](O)[C@@H](CO)O1,CO,278.0
Cc1ccc2c(nc3c(=O)n(C)c(=O)nc-3n2C)c1C,CC#N,448.0
Cc1ccc2c3ccccc3c3cc4ccccc4n3c2c1,CC#N,363.0
Cc1ccc2c3ccccc3c3nccn3c2c1,CC#N,300.0
Cc1ccc2cc(C)ccc2c1,C1CCCCC1,309.8853424
Cc1ccc2cc3c(=O)n(C)c(=O)n(C)c3nc2c1,CC#N,353.0
Cc1ccc2cc3c(=O)n(C)c(=O)n(C)c3nc2c1,CC(C)O,353.0
Cc1ccc2cc3c(=O)n(C)c(=O)n(C)c3nc2c1,CCO,353.0
Cc1ccc2cc3c(=O)n(C)c(=O)n(C)c3nc2c1,CO,352.0
Cc1ccc2cc3c(=O)n(C)c(=O)n(C)c3nc2c1,ClC(Cl)Cl,355.0
Cc1ccc2cc3c(=O)n(C)c(=O)n(C)c3nc2c1,ClCCl,355.0
Cc1ccc2cc3c4ccc(-c5ccc(/C=C(\C#N)C(=O)O)s5)cc4c4ccccc4n3c2c1,C1CCOC1,453.0
Cc1ccc2cc3cc(C)ncc3cc2c1,CCO,383.7298542
Cc1ccc2cc3ccccc3nc2n1,CC(C)=O,368.0
Cc1ccc2ccc3c(C)cc(C=O)c4ccc1c2c34,CO,405.0
Cc1ccc2ccc3c(C)cc(C=O)c4ccc1c2c34,ClCCl,410.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,C1CCCCC1,692.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,C1CCOC1,690.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,C1COCCO1,688.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,CC#N,681.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,CN(C)C=O,689.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,CO,679.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,CS(C)=O,692.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,Cc1ccccc1,694.0
Cc1ccc2ccc3c(c2n1)N/C(=C\C1=C([O-])/C(=C/C2=[NH+]c4c(ccc5ccc(C)nc45)C2(C)C)C1=O)C3(C)C,ClC(Cl)Cl,687.0
Cc1ccc2ccc3cccc4ccc1c2c34,CCCCCC,338.0
Cc1ccc2ccc3cccc4ccc1c2c34,CO,338.0
Cc1ccc2ccc3cccc4ccc1c2c34,ClCCl,341.0
Cc1ccc2ccccc2c1,C1CCCCC1,303.7667072
Cc1ccc2ccccc2c1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,546.0
Cc1ccc2cccnc2c1O,CO,415.0
Cc1ccc2nc(-c3cc(-c4ccc(Cl)cc4)n(-c4ccccc4)n3)c(NC(C)(C)C)n2c1,ClC(Cl)Cl,327.45
Cc1ccc2nc(-c3ccc(N4N=C(c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)CC4c4ccc(N(C)C)cc4)cc3)sc2c1,C1CCOC1,510.0
Cc1ccc2nc(-c3ccc(N4N=C(c5ccc(-c6ccc(C=C(C#N)C(=O)O)s6)s5)CC4c4ccccc4)cc3)sc2c1,C1CCOC1,502.0
Cc1ccc2nc(-c3cccc4nc(C)[nH]c(=O)c34)oc2c1,CN(C)C=O,310.0
Cc1ccc2nc(N=Cc3cc(Cl)cc(Cl)c3O)sc2c1,CO,273.0
Cc1ccc2nc3[nH]c(=O)[nH]c(=O)c3nc2c1,CC#N,382.0
Cc1ccc2nc3[nH]c(=O)[nH]c(=O)c3nc2c1,ClCCCl,384.0
Cc1ccc2nc3[nH]c(=O)[nH]c(=O)c3nc2c1C,CC#N,388.0
Cc1ccc2nc3c(=O)[nH]c(=O)[nH]c3nc2c1,CC#N,370.0
Cc1ccc2nc3c(=O)[nH]c(=O)[nH]c3nc2c1,ClCCCl,368.0
Cc1ccc2nc3c(=O)[nH]c(=O)[nH]c3nc2c1C,CC#N,375.0
Cc1ccc2nc3c(=O)n(C)c(=O)nc-3n(C)c2c1,CC#N,435.0
Cc1ccc2nc3c(nc2c1)c(-c1ccccc1)nn3C,C1CCCCC1,424.0
Cc1ccc2nc3c(nc2c1)c(-c1ccccc1)nn3C,C1CCOC1,425.0
Cc1ccc2nc3c(nc2c1)c(-c1ccccc1)nn3C,CC#N,423.0
Cc1ccc2nc3c4c(c5ccccc5c3nc2c1)OC(=O)CC4c1ccc(C(F)(F)F)cc1,ClC(Cl)Cl,411.0
Cc1ccc2nc3c4c(c5ccccc5c3nc2c1)OC(=O)CC4c1ccc(F)cc1,ClC(Cl)Cl,411.0
Cc1ccc2nc3cc4c(cc3c(-c3ccccc3)c2c1)[Si](C)(C)O[Si](C)(C)O[Si]4(C)C,ClCCl,371.0
Cc1ccc2nc3cc4c(cc3c(-c3ccccc3)c2c1)[Si](C)(C)O[Si]4(C)C,ClCCl,370.0
Cc1ccc2nccc(C)c2c1N,CS(C)=O,355.0
Cc1ccc2nnn(-c3c(C#N)c4c(N)ncnc4n3[C@H]3C[C@H](O)[C@@H](CO)O3)c2c1,CO,278.0
Cc1ccc2oc(=O)cc(C=Cc3ccc4c(c3)Sc3ccccc3N4C)c2c1,ClC(Cl)Cl,423.0
Cc1ccc2occ(CC(=O)NN)c2c1,C1CCOC1,292.0
Cc1ccc2occ(CC(=O)NN)c2c1,CC#N,289.0
Cc1ccc2occ(CC(=O)NN)c2c1,CC(C)=O,293.0
Cc1ccc2occ(CC(=O)NN)c2c1,CCCCO,290.0
Cc1ccc2occ(CC(=O)NN)c2c1,CCCO,281.0
Cc1ccc2occ(CC(=O)NN)c2c1,CCO,283.0
Cc1ccc2occ(CC(=O)NN)c2c1,CCOC(C)=O,296.0
Cc1ccc2occ(CC(=O)NN)c2c1,CN(C)C=O,313.0
Cc1ccc2occ(CC(=O)NN)c2c1,CO,279.0
Cc1ccc2occ(CC(=O)NN)c2c1,ClCCl,284.0
Cc1ccc2sc3cc(CCC(=O)O)ccc3c(=O)c2c1,CC#N,401.0
Cc1ccc2sc3cc(CCC(=O)O)ccc3c(=O)c2c1,CO,402.0
Cc1cccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,CC#N,391.0
Cc1cccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,CO,395.0
Cc1cccc(-c2[nH]c(=O)n3c2-c2ccccc2C3=O)c1O,ClCCl,392.0
Cc1cccc(-c2c(-c3cccc(C)c3)c3cc(C(C)(C)C)cc4c(-c5cccc(C)c5)c(-c5cccc(C)c5)c5cccc2c5[n+]34)c1,ClCCl,355.0
Cc1cccc(-c2c3ccccc3c(-c3cccc(C)n3)c3ccccc23)n1,ClCCl,393.0
Cc1cccc(-c2cccc(C)c2)c1,C1CCCCC1,260.2811036
Cc1cccc(-c2cnc3ccc4ccccc4n23)c1,ClCCl,325.0
Cc1cccc(-c2coc3cc(O)ccc3c2=O)c1,O,336.0
Cc1cccc(-c2nc3sc4ccccc4c3s2)c1,CS(C)=O,348.0
Cc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)c1,CS(C)=O,555.0
Cc1cccc(/C=C/c2cc(C)c3n2[B-](F)(F)[N+]2=CC=CC2=C3)n1,CS(C)=O,556.0
Cc1cccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)c1,CS(C)=O,430.0
Cc1cccc(C(=O)Nc2ccc(C(=O)/C=C/c3ccc(N(C)CCO)cc3)cc2)c1C,CS(C)=O,429.0
Cc1cccc(C)c1-c1cc2c(C)c3c4cc5nc6cc7c(cc6nc5cc4c3c(C)c2cc1-c1c(C)cccc1C)c1c(C)c2cc(-c3c(C)cccc3C)c(-c3c(C)cccc3C)cc2c(C)c71,ClC(Cl)Cl,503.0
Cc1cccc(C)c1-c1cc2c(C)c3c4cc5nc6ccc7c8c(C)c9cc(-c%10c(C)cccc%10C)c(-c%10c(C)cccc%10C)cc9c(C)c8c7c6nc5cc4c3c(C)c2cc1-c1c(C)cccc1C,ClC(Cl)Cl,487.0
Cc1cccc(C)c1-c1cc2c(C)c3c4ccc5nc6c(ccc7c8c(C)c9cc(-c%10c(C)cccc%10C)c(-c%10c(C)cccc%10C)cc9c(C)c8c76)nc5c4c3c(C)c2cc1-c1c(C)cccc1C,ClC(Cl)Cl,501.0
Cc1cccc(C)c1/C=C/c1nc(N2CCOCC2)c2c([n+]1[O-])CCCC2,ClCCl,384.0
Cc1cccc(C)c1C1=C(c2c(C)cccc2C)N(c2c(C(C)C)cccc2C(C)C)B(c2ccccc2)N1c1c(C(C)C)cccc1C(C)C,C1CCOC1,344.0
Cc1cccc(C)c1C1=C2C=CC(=[N+](C)C)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,700.0
Cc1cccc(C)c1C1=C2C=CC(=[N+](C)C)C=C2S(=O)(=O)c2cc(N(C)C)ccc21,O,704.0
Cc1cccc(C)c1C1=c2cc3cc4c5c(c3cc2C2(c3ccccc3Oc3ccccc32)c2cc3c6c7c(cc3cc21)CCCN7CCC6)CCC[N+]=5CCC4,ClCCl,873.0
Cc1cccc(C)c1N1C(c2ccccc2)=Cc2ccc3ccccc3[n+]2[B-]1(F)F,ClCCl,447.0
Cc1cccc(C)c1N1C(c2ccccc2)=Cc2cccc[n+]2[B-]1(F)F,ClCCl,397.0
Cc1cccc(C)c1Nc1ccc(/C=C/c2ccc3ccccc3c2)cc1,CC#N,356.0
Cc1cccc(C)c1Nc1ccc(/C=C/c2ccc3ccccc3c2)cc1,CCCCCC,350.0
Cc1cccc(C)c1Nc1ccc(/C=C/c2ccccc2)cc1,CC#N,347.0
Cc1cccc(C)c1Nc1ccc(/C=C/c2ccccc2)cc1,CCCCCC,341.0
Cc1cccc(C)c1Nc1ccc(/C=C/c2cccnc2)cc1,CC#N,351.0
Cc1cccc(C)c1Nc1ccc(/C=C/c2cccnc2)cc1,CCCCCC,346.0
Cc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(C)c5)c(-c5cccc(C)c5)n4[B-](F)(F)[N+]3=C2c2cccc(C)c2)c1,C1CCCCC1,579.0
Cc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(C)c5)c(-c5cccc(C)c5)n4[B-](F)(F)[N+]3=C2c2cccc(C)c2)c1,C1CCOC1,577.0
Cc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(C)c5)c(-c5cccc(C)c5)n4[B-](F)(F)[N+]3=C2c2cccc(C)c2)c1,CC#N,559.0
Cc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(C)c5)c(-c5cccc(C)c5)n4[B-](F)(F)[N+]3=C2c2cccc(C)c2)c1,Cc1ccccc1,571.0
Cc1cccc(C2=CC3=C(c4c(C)cc(C)cc4C)c4cc(-c5cccc(C)c5)c(-c5cccc(C)c5)n4[B-](F)(F)[N+]3=C2c2cccc(C)c2)c1,ClCCl,573.0
Cc1cccc(C2=Cc3c4ccccc4c4ccccc4[n+]3[B-](F)(F)O2)c1,ClC(Cl)Cl,434.0
Cc1cccc(C2=Cc3c4ccccc4cc[n+]3[B-](F)(F)O2)c1,ClC(Cl)Cl,401.5
Cc1cccc(C2=Cc3ccc4ccccc4[n+]3[B-](F)(F)O2)c1,ClC(Cl)Cl,429.0
Cc1cccc(Cl)c1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,543.0
Cc1cccc(N(c2ccc(/C=C/C=C/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2ccc(C)c(C)c2)c1,CS(C)=O,503.0
Cc1cccc(N(c2ccc(/C=C/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2ccc(C)c(C)c2)c1,CS(C)=O,493.0
Cc1cccc(N(c2ccc(/C=C3\SC(=S)N(CC(=O)O)C3=O)cc2)c2ccc(C)c(C)c2)c1,CS(C)=O,469.0
Cc1cccc(N(c2ccccc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)cc2)c1,C1CCOC1,387.0
Cc1cccc(N(c2ccccc2)c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)c1,C1CCOC1,412.0
Cc1cccc(N(c2ccccc2)c2ccc(C(C#N)=Cc3ccc4ccccc4c3)cc2)c1,C1CCOC1,413.0
Cc1cccc(N=Nc2c(N)n3c(nc4ccccc43)[nH]c2=O)c1,ClC(Cl)Cl,418.0
Cc1cccc(NC(=O)c2ccc(N(C)C)cc2)c1,C1CCCCC1,306.0
Cc1cccc(NC(=O)c2ccc(N(C)C)cc2)c1,C1CCOC1,311.0
Cc1cccc(NC(=O)c2ccc(N(C)C)cc2)c1,CC#N,314.0
Cc1cccc(NC(=O)c2ccc(N(C)C)cc2)c1,CCOCC,306.0
Cc1cccc(Nc2ccccc2C(=O)O)c1C,CC#N,351.0
Cc1cccc(Nc2ccccc2C(=O)O)c1C,CCOC(C)=O,351.0
Cc1cccc(Nc2ccccc2C(=O)O)c1C,CN(C)C=O,545.0
Cc1cccc(Nc2ccccc2C(=O)O)c1C,CO,345.0
Cc1cccc(Nc2ccccc2C(=O)O)c1C,ClC(Cl)Cl,357.0
Cc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,C1CCOC1,472.0
Cc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,CC#N,465.0
Cc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,CCCCCC,464.0
Cc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,Cc1ccccc1,475.0
Cc1cccc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,ClCCl,441.0
Cc1cccc2[n+]1[B-](c1ccccc1)(c1ccccc1)c1cccc3c4c5c(cccc5c-2c13)[B-](c1ccccc1)(c1ccccc1)[n+]1c(C)cccc1-4,ClCCl,542.0
Cc1cccc2c1nc1c(=O)n(C)c(=O)nc-1n2C,CC#N,440.0
Cc1cccc2c3ccccc3n(-c3ccc(-c4c(-c5ccccc5)c(C#N)c(C#N)c(-c5ccccc5)c4-c4ccc(-n5c6ccccc6c6cccc(C)c65)cc4)cc3)c12,Cc1ccccc1,339.0
Cc1cccc2cc(-c3cc4cccc(C)c4oc3=O)oc12,CC#N,369.0
Cc1cccc2cc(-c3cc4cccc(C)c4oc3=O)oc12,CCOC(C)=O,370.0
Cc1cccc2cc(-c3cc4cccc(C)c4oc3=O)oc12,CS(C)=O,373.0
Cc1cccc2cc(-c3cc4cccc(C)c4oc3=O)oc12,Cc1ccccc1,376.0
Cc1cccc2cc(-c3cc4cccc(C)c4oc3=O)oc12,O,367.0
Cc1cccc2cc(C)c3c4ccccc4[nH]c3c12,ClCCl,296.0
Cc1cccc2ccccc12,C1CCCCC1,293.9447384
Cc1cccc2nc(-c3cc(-c4ccc(Cl)cc4)n(-c4ccccc4)n3)c(NC(C)(C)C)n12,ClC(Cl)Cl,328.02
Cc1cccc2nc(-c3ccc(-c4cc(=O)cc(-c5ccccc5)o4)cc3)c(NC3CCCCC3)n12,ClCCl,356.0
Cc1cccc2nc3[nH]c(=O)[nH]c(=O)c3nc12,CC#N,380.0
Cc1cccc2nc3c(=O)[nH]c(=O)[nH]c3nc12,C1COCCO1,379.0
Cc1cccc2nc3c(=O)[nH]c(=O)[nH]c3nc12,CC#N,379.0
Cc1cccc2nc3c(=O)[nH]c(=O)[nH]c3nc12,CCO,381.0
Cc1cccc2nc3c(=O)[nH]c(=O)[nH]c3nc12,CO,382.0
Cc1cccc2nc3c(=O)[nH]c(=O)[nH]c3nc12,ClCCCl,380.0
Cc1cccc2nc3c(=O)[nH]c(=O)[nH]c3nc12,O,386.0
Cc1cccc2nc3c(=O)n(C)c(=O)nc-3n(C)c12,CC#N,439.0
Cc1ccccc1,C1CCCCC1,256.4760195
Cc1ccccc1,Cc1ccccc1,336.0
Cc1ccccc1-c1c2ccc(=[N+]3CCCC3)cc-2oc2cc(N3CCCC3)ccc12,CCO,558.0
Cc1ccccc1-c1c2ccc(=[N+]3CCCC3)cc-2oc2cc(N3CCCC3)ccc12,ClCCl,558.0
Cc1ccccc1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,CCO,564.0
Cc1ccccc1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,ClCCl,565.0
Cc1ccccc1-c1c2ccc(=[N+]3CCN(C(=O)OC(C)(C)C)CC3)cc-2oc2cc(N3CCN(C(=O)OC(C)(C)C)CC3)ccc12,CCO,556.0
Cc1ccccc1-c1c2ccc(=[N+]3CCN(C(=O)OC(C)(C)C)CC3)cc-2oc2cc(N3CCN(C(=O)OC(C)(C)C)CC3)ccc12,ClCCl,555.0
Cc1ccccc1-c1c2ccc(=[N+]3CCOCC3)cc-2oc2cc(N3CCCCC3)ccc12,CCO,560.0
Cc1ccccc1-c1c2ccc(=[N+]3CCOCC3)cc-2oc2cc(N3CCCCC3)ccc12,ClCCl,559.0
Cc1ccccc1-c1c2ccc(=[N+]3CCOCC3)cc-2oc2cc(N3CCOCC3)ccc12,CCO,556.0
Cc1ccccc1-c1c2ccc(=[N+]3CCOCC3)cc-2oc2cc(N3CCOCC3)ccc12,ClCCl,554.0
Cc1ccccc1-c1ccccc1C,C1CCCCC1,260.0780234
Cc1ccccc1-c1ncc2ccc3ccccc3n12,ClCCl,325.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,C1CCOC1,376.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,C1COCCO1,376.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CC#N,377.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CCCCCC,364.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CCCCCCC,376.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CCCCCO,376.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CCCCO,376.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CCCO,374.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CCO,376.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CCOC(C)=O,373.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CN(C)C=O,382.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CO,374.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,CS(C)=O,385.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,Cc1ccccc1,366.0
Cc1ccccc1/C(C#N)=C/c1ccc(N(C)C)cc1,ClC(Cl)Cl,378.0
Cc1ccccc1/C=C/c1cc(C)c2n1[B-](F)(F)[N+]1=CC=CC1=C2,CS(C)=O,556.0
Cc1ccccc1C,C1CCCCC1,258.2644628
Cc1ccccc1C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,430.0
Cc1ccccc1C1=C2C=CC(=[N+](C)C)C=C2P(=O)(C(C)(C)C)c2cc(N(C)C)ccc21,O,693.0
Cc1ccccc1C1=C2C=CC(=[N+](C)C)C=C2P(=O)([O-])c2cc(N(C)C)ccc21,O,666.0
Cc1ccccc1C1=C2C=CC(=[N+](C)C)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,699.0
Cc1ccccc1C1=C2C=CC(=[N+](C)C)C=C2S(=O)(=O)c2cc(N(C)C)ccc21,O,703.0
Cc1ccccc1C1=C2C=CC(=[N+](C)C)C=C2[Ge](C)(C)c2cc(N(C)C)ccc21,O,635.0
Cc1ccccc1C1=C2C=CC(=[N+]3CCCC3)C=C2P(=O)(c2ccccc2)c2cc(N(C)C)ccc21,O,703.0
Cc1ccccc1C1=C2C=CC(=[N+]3CCCC3)C=C2P(=O)(c2ccccc2)c2cc(N3CCCC3)ccc21,O,708.0
Cc1ccccc1C1=C2C=CC(=[NH2+])C=C2[Si](C)(C)c2cc(N)ccc21,O,593.0
Cc1ccccc1C1=C2C=c3c(oc4c3ccc3ccccc34)=[N+]2[B-](F)(F)n2c1cc1c3ccc4ccccc4c3oc12,C1CCCCC1,613.0
Cc1ccccc1C1=C2C=c3c(oc4c3ccc3ccccc34)=[N+]2[B-](F)(F)n2c1cc1c3ccc4ccccc4c3oc12,CCOC(C)=O,607.0
Cc1ccccc1C1=C2C=c3c(oc4c3ccc3ccccc34)=[N+]2[B-](F)(F)n2c1cc1c3ccc4ccccc4c3oc12,CO,605.5
Cc1ccccc1C1=C2C=c3c(oc4ccc(C(C)(C)C)cc34)=[N+]2[B-](F)(F)n2c1cc1c3cc(C(C)(C)C)ccc3oc12,C1CCCCC1,591.5
Cc1ccccc1C1=C2C=c3c(oc4ccc(C(C)(C)C)cc34)=[N+]2[B-](F)(F)n2c1cc1c3cc(C(C)(C)C)ccc3oc12,CCOC(C)=O,587.5
Cc1ccccc1C1=C2C=c3c(oc4ccc(C(C)(C)C)cc34)=[N+]2[B-](F)(F)n2c1cc1c3cc(C(C)(C)C)ccc3oc12,CO,586.0
Cc1ccccc1C1=C2C=c3c(oc4ccc(F)cc34)=[N+]2[B-](F)(F)n2c1cc1c3cc(F)ccc3oc12,C1CCCCC1,581.5
Cc1ccccc1C1=C2C=c3c(oc4ccc(F)cc34)=[N+]2[B-](F)(F)n2c1cc1c3cc(F)ccc3oc12,CCOC(C)=O,576.5
Cc1ccccc1C1=C2C=c3c(oc4ccc(F)cc34)=[N+]2[B-](F)(F)n2c1cc1c3cc(F)ccc3oc12,CO,574.5
Cc1ccccc1C1=c2cc3c(cc2[Si](C)(C)c2cc4c(cc21)CCCN4C)=[N+](C)CCC3,O,674.0
Cc1ccccc1C1=c2cc3c(cc2[Si](C)(C)c2cc4c(cc21)CCN4C)=[N+](C)CC3,O,691.0
Cc1ccccc1C1=c2cc3cc4c5c(c3cc2C2(c3ccccc3Oc3ccccc32)c2cc3c6c7c(cc3cc21)CCCN7CCC6)CCC[N+]=5CCC4,ClCCl,879.0
Cc1ccccc1C1CC(=O)Oc2c1c1nc3ccccc3nc1c1ccccc21,ClC(Cl)Cl,410.0
Cc1ccccc1CN(Cc1ccccc1C)c1nc(C#N)c(N(Cc2ccccc2C)Cc2ccccc2C)nc1C#N,ClC(Cl)Cl,501.0
Cc1ccccc1N(c1ccc(C(C)(C)C)cc1)c1ccc2ccc3c(N(c4ccc(C(C)(C)C)cc4)c4ccccc4C)ccc4ccc1c2c43,Cc1ccccc1,432.0
Cc1ccccc1N(c1ccccc1C)c1ccc2ccc3c(N(c4ccccc4C)c4ccccc4C)ccc4ccc1c2c43,Cc1ccccc1,425.0
Cc1ccccc1N1c2c(sc3ccccc23)Sc2sc3ccccc3c21,ClCCl,400.0
Cc1ccccc1N1c2sc3ccccc3c2Sc2sc3ccccc3c21,ClCCl,325.0
Cc1ccccc1N=Nc1c(N)n2c(nc3ccccc32)[nH]c1=O,ClC(Cl)Cl,417.0
Cc1ccccc1Oc1ccc2c3c(cccc13)C(=O)N(CCO)C2=O,ClC(Cl)Cl,355.0
Cc1cccn2c(NC(C)(C)C)c(-c3cc(-c4ccc(Cl)cc4)n(-c4ccccc4)n3)nc12,ClC(Cl)Cl,315.21
Cc1cccn2c1cc1c3ccccc3nc(-c3ccco3)c12,CS(C)=O,400.0
Cc1cccn2c1cc1c3ccccc3nc(-c3cccs3)c12,CS(C)=O,398.0
Cc1cccn2c3c(c(-c4ccc(Br)cc4)c12)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,338.0
Cc1ccn2c(NC(C)(C)C)c(-c3cc(-c4ccc(Cl)cc4)n(-c4ccccc4)n3)nc2c1,ClC(Cl)Cl,317.12
Cc1ccn2c(NC(C)(C)C)c(-c3cc(-c4ccc(Cl)cc4)n(C)n3)nc2c1,ClC(Cl)Cl,313.72
Cc1ccn2c3c(c(-c4ccc(Br)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,318.0
Cc1ccn2c3c(c(-c4ccc(C#N)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,344.0
Cc1ccn2c3c(c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c2c1)CN(CCNC(=O)OC(C)(C)C)C3=O,ClCCl,332.0
Cc1ccn2c3c(c(C(=O)c4ccccc4C(=O)O)c2c1)C(=O)c1ccccc1C3=O,CN(C)C=O,504.0
Cc1ccnc(-c2cc(/C=C/c3ccc(N4CCCC4)cc3)ccn2)c1,ClCCl,334.0
Cc1ccsc1-c1cc2c3cc(-c4sccc4C)c4nc(C(F)(F)C(F)(F)C(F)(F)F)nc5c(-c6sccc6C)cc(c6cc(-c7sccc7C)c7nc(C(F)(F)C(F)(F)C(F)(F)F)nc1c7c26)c3c45,C1CCOC1,532.0
Cc1ccsc1-c1ccc(-c2ccc(-c3sccc3C)s2)s1,CCCCCCCCCCCCCC,382.0
Cc1ccsc1-c1ccc(-c2sc(-c3ccc(-c4nc(-c5ccc(-c6cc(C)c(-c7ccc(-c8sccc8C)c8nsnc78)s6)cc5)nc(-c5ccc(-c6cc(C)c(-c7ccc(-c8sccc8C)c8nsnc78)s6)cc5)n4)cc3)cc2C)c2nsnc12,C1COCCO1,373.0
Cc1ccsc1C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,430.0
Cc1cn(C(F)(F)F)c(=O)[nH]c1=O,CC#N,255.0
Cc1cn(C)c(=O)nc1-n1cncn1,O,323.0
Cc1cn(C)c(C)c1-c1c(O)c(=O)c1=O,CO,347.0
Cc1cn(CCCn2cc(C)c(=O)[nH]c2=O)c(=O)nc1-n1cncn1,O,325.0
Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1,C1COCCO1,342.0
Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1,CC#N,340.0
Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1,CCCCO,350.0
Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1,CCCO,350.0
Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1,CCO,349.0
Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1,CCOC(C)=O,343.0
Cc1cnc(NC(=O)C2=C(O)c3ccccc3S(=O)(=O)N2C)s1,CO,346.0
Cc1cnc(NC(=O)C2=C([O-])c3ccccc3S(=O)(=O)N2C)s1,CC#N,371.0
Cc1cnc(NC(=O)C2=C([O-])c3ccccc3S(=O)(=O)N2C)s1,CCCCO,369.0
Cc1cnc(NC(=O)C2=C([O-])c3ccccc3S(=O)(=O)N2C)s1,CCCO,368.0
Cc1cnc(NC(=O)C2=C([O-])c3ccccc3S(=O)(=O)N2C)s1,CCO,366.0
Cc1cnc(NC(=O)C2=C([O-])c3ccccc3S(=O)(=O)N2C)s1,CO,364.0
Cc1cnc2c(ccc3c(C)c(C)cnc32)c1C,ClCCl,273.0
Cc1coc2cc(O)ccc2c1=O,O,334.0
Cc1csc(C)c1C1=C(c2c(C)sc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)c2C)C(F)(F)C(F)(F)C1(F)F,C1CCOC1,339.0
Cc1csc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,C1CCOC1,476.0
Cc1csc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,CC#N,470.0
Cc1csc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,CCCCCC,477.0
Cc1csc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,Cc1ccccc1,479.0
Cc1csc2[n+]1[B-](F)(F)n1c(c3cccc4cccc1c43)=N2,ClCCl,445.0
Cc1cscc1-c1cc2c3cc(-c4cscc4C)c4nc(C(F)(F)C(F)(F)C(F)(F)F)nc5c(-c6cscc6C)cc(c6cc(-c7cscc7C)c7nc(C(F)(F)C(F)(F)C(F)(F)F)nc1c7c26)c3c45,C1CCOC1,493.0
Cc1nc(-c2cc(C(F)(F)F)ccc2O)n2c1CCCC2,ClCCl,316.0
Cc1nc(-c2cc(F)ccc2O)n2c1CCCC2,ClCCl,326.0
Cc1nc(-c2cc(N)ccc2O)n2c1CCCC2,ClCCl,344.0
Cc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,C1CCOC1,343.0
Cc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,CN(C)C=O,343.0
Cc1nc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)n1,ClC(Cl)Cl,343.0
Cc1nc(-c2ccccc2)c2ccccn12,C1CCCCC1,374.0
Cc1nc(-c2ccccc2)c2ccccn12,CC#N,364.0
Cc1nc(-c2ccccc2)c2ccccn12,CO,354.0
Cc1nc(-c2ccccc2)c2ccccn12,ClCCl,367.0
Cc1nc(-c2ccccc2)c2ccccn12,O,338.0
Cc1nc(-c2ccccc2O)n2c1CCCC2,ClCCl,314.0
Cc1nc(Cl)c2cc(-c3nnc(-c4ccc(Cl)cc4)o3)ccn12,ClCCl,273.0
Cc1nc(Cl)c2cc(-c3nnc(-c4ccc(Cl)cc4Cl)o3)ccn12,ClCCl,280.0
Cc1nc(Cl)c2cc(-c3nnc(-c4ccccc4)o3)ccn12,ClCCl,285.0
Cc1nc(Cl)c2cc(-c3nnc(-c4ccccc4F)o3)ccn12,ClCCl,277.0
Cc1nc(Cl)c2cc(-c3nnc(COc4ccc(-c5ccccc5)cc4)o3)ccn12,CC#N,367.0
Cc1nc(Cl)c2cc(-c3nnc(COc4ccc(Cl)cc4)o3)ccn12,CC#N,369.0
Cc1nc(Cl)c2cc(-c3nnc(COc4ccc([N+](=O)[O-])cc4)o3)ccn12,CC#N,368.0
Cc1nc(Cl)c2cc(-c3nnc(COc4ccccc4)o3)ccn12,CC#N,377.0
Cc1nc2c(ccc3c2sc(/C=C/c2cc4c5c(c2)CCCN5CCC4)[n+]3C)s1,CO,574.0
Cc1nc2c(ccc3c2sc(/C=C/c2cc4c5c(c2)CCCN5CCC4)[n+]3C)s1,ClC(Cl)Cl,595.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(-n4c5ccccc5c5ccccc54)cc2)[n+]3C)s1,CO,446.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(-n4c5ccccc5c5ccccc54)cc2)[n+]3C)s1,ClC(Cl)Cl,488.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N(C)C)cc2)[n+]3C)s1,CO,534.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N(C)C)cc2)[n+]3C)s1,ClC(Cl)Cl,557.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N(CCO)CCO)cc2)[n+]3C)s1,CO,532.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N(CCO)CCO)cc2)[n+]3C)s1,ClC(Cl)Cl,552.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N(c4ccccc4)c4ccccc4)cc2)[n+]3C)s1,CO,522.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N(c4ccccc4)c4ccccc4)cc2)[n+]3C)s1,ClC(Cl)Cl,561.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N4CCN(C)CC4)cc2)[n+]3C)s1,CO,505.0
Cc1nc2c(ccc3c2sc(/C=C/c2ccc(N4CCN(C)CC4)cc2)[n+]3C)s1,ClC(Cl)Cl,545.0
Cc1nc2c(ccc3ccc(N(C)C)cc32)oc1=O,c1ccccc1,426.0
Cc1nc2c(ccc3ccc(O)cc32)oc1=O,c1ccccc1,370.0
Cc1nc2c(ccc3ccccc32)oc1=O,c1ccccc1,364.0
Cc1nc2c3ccccc3c3ccccc3n2c1C,CC#N,318.0
Cc1nc2cc(/C=C/c3ccc(N(C)C)cc3)ccc2nc1-c1ccccc1,C1COCCO1,415.0
Cc1nc2cc(/C=C/c3ccc(N(C)C)cc3)ccc2nc1-c1ccccc1,CC#N,407.0
Cc1nc2cc(/C=C/c3ccc(N(C)C)cc3)ccc2nc1-c1ccccc1,ClCCl,407.0
Cc1nc2cc3c4c(cccc4c2o1)C(=O)OC3=O,CCO,362.0
Cc1nc2ccc(/C=C/c3ccc(N(C)C)cc3)cc2nc1-c1ccccc1,C1COCCO1,403.0
Cc1nc2ccc(/C=C/c3ccc(N(C)C)cc3)cc2nc1-c1ccccc1,CC#N,400.0
Cc1nc2ccc(/C=C/c3ccc(N(C)C)cc3)cc2nc1-c1ccccc1,ClCCl,408.0
Cc1nc2cccc(-c3nc4ccc(Cl)cc4o3)c2c(=O)[nH]1,CN(C)C=O,310.0
Cc1nc2cccc(-c3nc4ccc([N+](=O)[O-])cc4[nH]3)c2c(=O)[nH]1,CN(C)C=O,310.0
Cc1nc2cccc(-c3nc4ccccc4s3)c2c(=O)[nH]1,CN(C)C=O,319.0
Cc1nc2ccccc2o1,C1CCCCC1,277.0
Cc1nccnc1C(=O)C=Cc1ccc(Br)cc1,CCO,315.0
Cc1nccnc1C(=O)C=Cc1ccc(Cl)cc1,CCO,305.0
Cc1nccnc1C(=O)C=Cc1ccc(N(C)C)cc1,CCO,310.0
Cc1nccnc1C(=O)C=Cc1ccc(OCc2ccccc2)cc1,CCO,310.0
Cc1nccnc1C(=O)C=Cc1ccc([N+](=O)[O-])cc1,CCO,315.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,C1CCCCC1,376.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,C1CCOC1,376.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,C1COCCO1,377.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,CC#N,372.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,CCCCCCC,373.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,CCO,377.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,CN(C)C=O,375.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,CO,377.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,O,391.0
Cc1nn(-c2ccccc2)c(C2=NN(c3ccc(Br)cc3)[C@@H](c3ccccc3)[C@@H]2c2ccccc2)c1C#N,OCCO,379.0
Cc1nn2c(N=Nc3ccc(Cl)cc3)c(-c3ccccc3)[nH]c2c1N=Nc1ccccc1,C1COCCO1,532.0
Cc1nn2c(N=Nc3ccc([N+](=O)[O-])cc3)c(-c3ccccc3)[nH]c2c1N=Nc1ccccc1,C1COCCO1,585.0
Cc1nn2c(N=Nc3cccc(Cl)c3)c(-c3ccccc3)[nH]c2c1N=Nc1ccccc1,C1COCCO1,533.0
Cc1nnc(-c2cc(-c3nnc(C)o3)c(-n3c4ccccc4c4ccccc43)cc2-n2c3ccccc3c3ccccc32)o1,Cc1ccccc1,359.0
Cc1nnc(-c2cc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)cc2-c2nnc(C)o2)o1,ClCCl,353.0
Cc1nnc(-c2ccc(C=C(C#N)c3ccc4c(c3)c3cc(C(C#N)=Cc5ccc(-c6nnc(C)o6)cc5)ccc3n4C)cc2)o1,ClCCl,417.0
Cc1noc2nc3c(F)c(F)c(F)c(F)c3cc12,CCO,335.0
Cc1oc(-c2ccccc2)nc1C(=O)O,C1CCCCC1,269.0
Cc1oc(-c2ccccc2)nc1C(=O)O,CC#N,267.0
Cc1oc(-c2ccccc2)nc1C(=O)O,CCO,273.0
Cc1oc(-c2ccccc2)nc1C(=O)O,CCOC(C)=O,267.0
Cc1oc(-c2ccccc2)nc1C(=O)O,O,273.0
Cc1oc2c(Cl)cc3c(C)cc(=O)oc3c2c1C,C1CCCCC1,338.0
Cc1oc2c(Cl)cc3c(C)cc(=O)oc3c2c1C,CCO,335.0
Cc1occc1C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,426.0
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,427.0
Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)CCO)cc2)cc1,CS(C)=O,431.0
Cc1s[c+](N2CCOCC2)sc1-c1cc(I)cc(I)c1[O-],C1CCOC1,425.0
Cc1s[c+](N2CCOCC2)sc1-c1cc(I)cc(I)c1[O-],CC#N,409.0
Cc1s[c+](N2CCOCC2)sc1-c1cc(I)cc(I)c1[O-],CO,371.0
Cc1s[c+](N2CCOCC2)sc1-c1cc(I)cc(I)c1[O-],ClCCl,413.0
Cc1sc(-c2ccc(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc2)c(C)c1C1=C(c2c(C)n(C)c3ccccc23)C(F)(F)C(F)(F)C1(F)F,C1CCOC1,313.0
Cc1sc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1C1=C(c2cc(/C=C(\C#N)C(=O)O)sc2C)CCC1,ClCCl,380.0
Cc1sc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1C1=C(c2cc(C(=O)O)sc2C)CCC1,ClCCl,380.0
Cc1sc(Cl)cc1-c1nc(-c2ccc(Cl)cc2)[nH]c1-c1cc(Cl)sc1C,CC#N,309.0
Cc1sc(Cl)cc1-c1nc(-c2ccccc2)[nH]c1-c1cc(Cl)sc1C,CC#N,298.0
ClB1c2ccccc2Nc2ccccc21,ClCCl,366.0
ClC(Cl)(Cl)Cl,CC#N,402.0
ClC(c1cccc2cc3cc4cc5ccccc5cc4cc3cc12)c1cccc2cc3cc4cc5ccccc5cc4cc3cc12,CC#N,614.0
ClC1=CN2C[n+]3cc(Cl)ccc3N=C2C=C1,CO,433.0
ClP1(Cl)=NP(Cl)(Cl)=NP(Cl)(Oc2ccc3ccc4cccc5ccc2c3c45)=N1,ClCCl,343.0
ClP1(Cl)=N[P@@](Cl)(Oc2ccc3ccc4cccc5ccc2c3c45)=N[P@@](Cl)(Oc2ccc3ccc4cccc5ccc2c3c45)=N1,ClCCl,343.0
ClP1(Cl)=N[P@](Cl)(Oc2ccc3ccc4cccc5ccc2c3c45)=N[P@@](Cl)(Oc2ccc3ccc4cccc5ccc2c3c45)=N1,ClCCl,343.0
Clc1cc(Cl)c(B2c3ccccc3Nc3ccccc32)c(Cl)c1,ClCCl,396.0
Clc1cc(Cl)c([C](c2c(Cl)cc(Cl)cc2Cl)c2c(Cl)cc(-n3c4ccccc4c4ccccc43)cc2Cl)c(Cl)c1,ClC(Cl)Cl,598.0
Clc1ccc(-[n+]2nc3c(-c4ccccc4)cc(Cl)cc3c3ccccc32)cc1,ClCCl,478.0
Clc1ccc(-c2[o+]c3c(-c4ccc(Cl)cc4)c(-c4ccc(Cl)cc4)c4cccc5ccc(c2-c2ccc(Cl)cc2)c3c54)cc1,ClCCl,498.0
Clc1ccc(-c2c3nc(c(-c4ccc(Cl)cc4)c4ccc([nH]4)c(-c4ccc(Cl)cc4)c4nc(c(-c5ccc(Cl)cc5)c5ccc2[nH]5)C=C4N2CCOCC2)C=C3)cc1,CS(C)=O,652.0
Clc1ccc(-c2cc(-c3nnc(-c4cccc(Br)c4)o3)n(Cc3ccc(Cl)nc3)n2)cc1,ClCCl,274.0
Clc1ccc(-c2cc(-c3nnc(-c4ccccc4)o3)n(Cc3ccc(Cl)nc3)n2)cc1,ClCCl,275.0
Clc1ccc(-c2cc(-c3nnc(-c4ccccc4)o3)n(Cc3ccccc3)n2)cc1,ClCCl,267.0
Clc1ccc(-c2cc3cc(-c4nnc(-c5ccccc5)o4)ccn3n2)cc1,C1CCCCC1,342.0
Clc1ccc(-c2cccc3cnc(-c4ccccc4)n23)cc1,ClCCl,338.0
Clc1ccc(-c2cccc3ncc(-c4ccccc4)n23)cc1,ClCCl,338.0
Clc1ccc(-c2ccnc3ncnn23)cc1,ClCCl,309.0
Clc1ccc(-c2cn3ccc(C=Cc4ccccc4)cc3n2)cc1,Cc1ccccc1,413.0
Clc1ccc(-c2cnn(-c3ccc(Cl)cc3)n2)cc1,CO,283.0
Clc1ccc(-c2nc(-c3ccccc3)c(N(c3ccccc3)c3ccccc3)s2)cc1,ClC(Cl)Cl,371.0
Clc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClC(Cl)Cl,329.0
Clc1ccc(-c2nc3ccccc3c3cc4ccccn4c23)s1,CS(C)=O,407.0
Clc1ccc(-c2nc3ccccc3n2-c2ccccc2)cc1,CC#N,295.0
Clc1ccc(-c2nc3ncccn3n2)cc1,ClCCl,305.0
Clc1ccc(-c2nc3sc4ccccc4c3s2)cc1,CS(C)=O,351.0
Clc1ccc(-c2nnc3ccccn23)cc1,ClCCl,288.0
Clc1ccc(-c2oc3cccc4[n+]3c2-c2ccccc2-4)cc1,ClCCl,370.0
Clc1ccc(-n2cccc2)cc1,ClC(Cl)Cl,312.0
Clc1ccc(-n2ncc(-c3ccccc3)n2)cc1,CO,298.0
Clc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3o2)cc1,C1CCCCC1,330.0
Clc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3o2)cc1,CO,330.0
Clc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3s2)cc1,C1CCCCC1,340.0
Clc1ccc(/C=C(\c2ccccc2)c2nc3ccccc3s2)cc1,CO,340.0
Clc1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,345.0
Clc1ccc(/C=C/c2ccncn2)cc1,ClCCl,310.0
Clc1ccc(/C=C/c2cnc3ccccc3n2)cc1,ClCCl,355.0
Clc1ccc(/C=C/c2nc(-c3ccccc3)[nH]c2/C=C/c2ccc(Cl)cc2)cc1,ClCCl,375.0
Clc1ccc(/C=C/c2nc3ccccc3o2)cc1,C1CCCCC1,325.0
Clc1ccc(/C=C/c2nc3ccccc3o2)cc1,CO,330.0
Clc1ccc(/C=C/c2nc3ccccc3s2)cc1,C1CCCCC1,340.0
Clc1ccc(/C=C/c2nc3ccccc3s2)cc1,CO,340.0
Clc1ccc(C2=C(c3ccc(Cl)cc3)C3=Cc4ccccc4NB3OB3Nc4ccccc4C=C32)cc1,ClCCl,413.0
Clc1ccc(C2=C(c3ccc(Cl)cc3)N3C(=C(c4ccc(Cl)cc4)c4cccc5c(-c6ccc(Cl)cc6)c(-c6ccc(Cl)cc6)[o+]c3c45)c3ccc(Cl)cc32)cc1,ClCCl,503.0
Clc1ccc(C2=C(c3ccc(Cl)cc3)c3cccc4c(-c5ccc(Cl)cc5)c5c6ccc(Cl)cc6c(-c6ccc(Cl)cc6)c(-c6ccc(Cl)cc6)[n+]5c(c34)O2)cc1,ClCCl,503.0
Clc1ccc(C2=Cc3c(-c4ccc(Cl)cc4)cc[n+]4cccc(c34)O2)cc1,ClCCl,396.0
Clc1ccc(N2c3c(sc4ccccc34)Sc3sc4ccccc4c32)cc1,ClCCl,309.0
Clc1ccc(N2c3sc4ccccc4c3Sc3c2sc2ccccc32)cc1,ClCCl,418.0
Clc1ccc(N2c3sc4ccccc4c3Sc3sc4ccccc4c32)cc1,ClCCl,310.0
Clc1ccc(N=Nc2c(-c3ccccc3)[nH]c3ccccc23)cc1,CS(C)=O,412.0
Clc1ccc2c(-c3ccccc3)c(-c3ccccc3)[n+]3c4ccccc4c(-c4ccccc4)c(-c4ccccc4)c3c2c1,ClCCl,465.0
Clc1ccc2c(c1)Nc1ccccc1S2,CC#N,323.0
Clc1ccc2c(c1)Nc1ccccc1S2,CO,323.0
Clc1ccc2c(c1)c1ccccc1c1nc3ccccc3n21,CC#N,331.0
Clc1ccc2c(c1)c1ccccc1n1c3ccccc3nc21,CC#N,308.0
Clc1ccc2nc3cc4ccccc4cc3c(-c3ccccc3)c2c1,ClCCl,402.0
Clc1cccc(-c2nc3sc4ccccc4c3s2)c1,CS(C)=O,351.0
Clc1cccc(-n2cccc2)c1,ClC(Cl)Cl,311.0
Clc1ccccc1-c1ccccc1,CCOC(C)=O,356.0
Clc1ccccc1-c1nc2sc3ccccc3c2s1,CS(C)=O,347.0
Clc1ccccc1-n1cccc1,ClC(Cl)Cl,310.0
Clc1ccccc1N1c2c(sc3ccccc23)Sc2sc3ccccc3c21,ClCCl,400.0
Clc1ccccc1N1c2sc3ccccc3c2Sc2c1sc1ccccc21,ClCCl,421.0
Clc1ccccc1N1c2sc3ccccc3c2Sc2sc3ccccc3c21,ClCCl,314.0
Clc1cnc2nn3ccccc3c2c1,C1CCOC1,373.0
Clc1cnc2nn3ccccc3c2n1,C1CCOC1,404.0
Clc1nc(Cl)nc(Nc2cc3ccc4cccc5ccc(c2)c3c45)n1,CC#N,336.0
Clc1nc(Cl)nc(Nc2cc3ccc4cccc5ccc(c2)c3c45)n1,CCCCOCCCC,336.0
Clc1nc(Cl)nc(Nc2cc3ccc4cccc5ccc(c2)c3c45)n1,CO,334.0
Clc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,C1COCCO1,446.0
Clc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CC#N,444.5
Clc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CCCCOCCCC,443.0
Clc1nc(Cl)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CCOC(C)=O,442.0
Clc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,C1COCCO1,397.0
Clc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CC#N,398.0
Clc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CCCCOCCCC,395.0
Clc1nc(Cl)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CCOC(C)=O,394.0
Clc1nc(Cl)nc(Nc2ccc3ccc4cccc5ccc2c3c45)n1,CC#N,341.0
Clc1nc(Cl)nc(Nc2ccc3ccc4cccc5ccc2c3c45)n1,CCCCOCCCC,341.0
Clc1nc(Cl)nc(Nc2ccc3ccc4cccc5ccc2c3c45)n1,CO,340.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,C1COCCO1,444.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CC#N,443.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CCCCOCCCC,443.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3c4cccc5cccc(c6cccc2c63)c54)n1,CCOC(C)=O,442.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3cc4ccccc4cc3c2)n1,C1COCCO1,398.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CC#N,397.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CCCCOCCCC,398.0
Clc1nc(Nc2ccccc2)nc(Nc2ccc3cc4ccccc4cc3c2)n1,CCOC(C)=O,396.0
Clc1ncc(-c2c3ccccc3c(-c3cnc(Cl)nc3)c3ccccc23)cn1,CCO,394.0
Clc1ncc(-c2c3ccccc3c(-c3cnc(Cl)nc3)c3ccccc23)cn1,ClCCl,396.0
Clc1nccc(NN=Cc2ccccc2)n1,CCO,326.0
Clc1nnc(O/N=C/c2ccc(N(c3ccc(Br)cc3)c3ccc(Br)cc3)cc2)nn1,ClCCl,520.0
Clc1nnc(O/N=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)nn1,ClCCl,518.0
Clc1nnc(Oc2ccc(N(c3ccc(Br)cc3)c3ccc(Br)cc3)cc2)nn1,ClCCl,524.0
Clc1nnc(Oc2ccc(N(c3ccccc3)c3ccccc3)cc2)nn1,ClCCl,525.0
Cn1c(-c2ccc(-c3ccc(-c4ccc(-c5n(C)c6ccccc6[n+]5C)cc4)cc3)cc2)[n+](C)c2ccccc21,O,312.0
Cn1c(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)cc3)cc2)nc2c(-c3cccs3)sc(-c3cccs3)c21,C1CCOC1,342.0
Cn1c(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)cc2)nc2c(-c3cccs3)sc(-c3cccs3)c21,C1CCOC1,388.0
Cn1c(-c2ccc(-c3ccc(C=C(C#N)C(=O)O)s3)s2)nc2c(-c3cccs3)sc(-c3cccs3)c21,C1CCOC1,414.0
Cn1c(-c2ccccc2)c(N=Nc2n[nH]c(S)n2)c2ccccc21,CS(C)=O,394.0
Cn1c(-c2ccccc2)c(N=Nc2nc(-c3cc4ccccc4oc3=O)cs2)c2ccccc21,CS(C)=O,471.0
Cn1c(-c2ccccc2)c(N=Nc2nc3ccc([N+](=O)[O-])cc3s2)c2ccccc21,ClC(Cl)Cl,566.0
Cn1c(-c2ccccc2)c(N=Nc2nc3ccccc3s2)c2ccccc21,ClC(Cl)Cl,527.0
Cn1c(-c2cnc(-c3nc4ccccc4n3C)cn2)nc2ccccc21,CS(C)=O,397.0
Cn1c(/C=C/c2ccc(/C=C/c3nc4ccccc4[nH]3)cc2)[n+](C)c2ccccc21,C1CCOC1,363.0
Cn1c(/C=C/c2ccc(/C=C/c3nc4ccccc4[nH]3)cc2)[n+](C)c2ccccc21,CC#N,377.0
Cn1c(/C=C/c2ccc(/C=C/c3nc4ccccc4[nH]3)cc2)[n+](C)c2ccccc21,CC(C)=O,386.0
Cn1c(/C=C/c2ccc(/C=C/c3nc4ccccc4[nH]3)cc2)[n+](C)c2ccccc21,CN(C)C=O,389.0
Cn1c(/C=C/c2ccc(/C=C/c3nc4ccccc4[nH]3)cc2)[n+](C)c2ccccc21,CO,391.0
Cn1c(/C=C/c2ccc(/C=C/c3nc4ccccc4[nH]3)cc2)[n+](C)c2ccccc21,CS(C)=O,392.0
Cn1c(/C=C/c2ccc(/C=C/c3nc4ccccc4[nH]3)cc2)[n+](C)c2ccccc21,O,376.0
Cn1c(=O)/c(=C/c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s/c1=C(\C#N)C(=O)O,ClCCl,496.0
Cn1c(=O)c(-c2ccccc2)nc2ccccc21,c1ccccc1,369.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,C1CCOC1,408.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,CC(C)=O,407.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,CCOC(C)=O,407.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,CO,406.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,CS(C)=O,417.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,Cc1ccccc1,421.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,ClCCl,420.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2C(=O)O)c(O)c2ccccc21,O,421.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,C1CCOC1,428.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,CC(C)=O,421.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,CCOC(C)=O,423.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,CO,422.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,CS(C)=O,419.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,Cc1ccccc1,430.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,ClCCl,415.0
Cn1c(=O)c(/N=N/c2cc(S(=O)(=O)O)ccc2S(=O)(=O)O)c(O)c2ccccc21,O,413.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,C1CCOC1,490.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,CC(C)=O,483.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,CCOC(C)=O,482.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,CO,475.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,CS(C)=O,487.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,Cc1ccccc1,486.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,ClCCl,487.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccc([N+](=O)[O-])cc3S(=O)(=O)O)cc2)c(O)c2ccccc21,O,476.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,C1CCOC1,412.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,CC(C)=O,407.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,CCOC(C)=O,411.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,CO,400.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,CS(C)=O,396.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,Cc1ccccc1,414.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,ClCCl,415.0
Cn1c(=O)c(/N=N/c2ccc(Nc3ccccc3)c(S(=O)(=O)O)c2)c(O)c2ccccc21,O,385.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,C1CCOC1,467.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,CC(C)=O,465.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,CCOC(C)=O,464.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,CO,468.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,CS(C)=O,470.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,Cc1ccccc1,469.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,ClCCl,467.0
Cn1c(=O)c(/N=N/c2ccc(S(=O)(=O)O)c3ccccc23)c(O)c2ccccc21,O,456.0
Cn1c(=O)c(C=O)c(O)c2ccccc21,CO,398.0
Cn1c(=O)c2c(nc(/C=C/C(=O)OC(C)(C)C)n2C)n(C)c1=O,ClCCl,348.0
Cn1c(=O)c2c(nc(/C=C/c3ccc(F)cc3)n2C)n(C)c1=O,ClCCl,353.0
Cn1c(=O)c2c(nc(/C=C/c3ccccc3)n2C)n(C)c1=O,ClCCl,354.0
Cn1c(=O)c2c(ncn2C)n(C)c1=O,O,258.0
Cn1c(=O)cc(C(=O)c2ccccc2)c2sc(-c3ccc(C(F)(F)F)cc3)cc21,CC#N,388.0
Cn1c(=O)cc(C(=O)c2ccccc2)c2sc(-c3ccc(C(F)(F)F)cc3)cc21,ClCCl,398.0
Cn1c(=O)cc(C(=O)c2ccccc2)c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,CC#N,430.0
Cn1c(=O)cc(C(=O)c2ccccc2)c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,ClCCl,438.0
Cn1c(=O)cc(C(=O)c2ccccc2)c2sc(-c3ccc(OC(F)(F)F)cc3)cc21,CC#N,394.0
Cn1c(=O)cc(C(=O)c2ccccc2)c2sc(-c3ccc(OC(F)(F)F)cc3)cc21,ClCCl,400.0
Cn1c(=O)cc(O)c2ccccc21,CO,400.0
Cn1c(=O)nc2n(C)c3ccccc3nc-2c1=O,CC#N,437.0
Cn1c(=O)nc2n(C)c3ccccc3nc-2c1=O,CC1CCCO1,460.0
Cn1c(C#Cc2ccc(C#N)cc2)cc2ccccc21,C1CCCCC1,357.0
Cn1c(C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)ccc1C=C(C#N)C(=O)O,ClC(Cl)Cl,514.0
Cn1c(N)c(N=Nc2nc(-c3cc4ccccc4oc3=O)cs2)c(=O)n(C)c1=O,CS(C)=O,444.0
Cn1c2cc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)ccc2c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc21,ClCCl,349.0
Cn1c2cc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)s3)ccc2c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)s3)cc21,ClCCl,406.0
Cn1c2cc(N3CCCCC3)c(F)cc2c(=O)c2cc(F)c(N3CCCCC3)cc21,CCO,368.0
Cn1c2ccc(-c3ccc(-c4ccccc4)s3)cc2c2cc(-c3ccc(-c4ccccc4)s3)ccc21,C1CCOC1,639.05
Cn1c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2c2cc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)ccc21,ClCCl,341.0
Cn1c2ccc(-c3sccc3-c3cccs3)cc2c2cc(-c3sccc3-c3cccs3)ccc21,OCc1ccccc1,675.72
Cn1c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2c2cc(/C=C(\C#N)C(=O)O)ccc21,C1CCOC1,360.0
Cn1c2ccc(Br)cc2c2c(-c3ccccc3)c3oc4ccccc4c3cc21,CCO,333.0
Cn1c2ccc(C#N)cc2c2c(-c3ccccc3)c3oc4ccccc4c3cc21,CCO,330.0
Cn1c2ccccc2c2c(-c3ccc(C(F)(F)F)cc3)c3oc4ccccc4c3cc21,CCO,331.0
Cn1c2ccccc2c2c(-c3ccc(Cl)cc3)c3oc4ccccc4c3cc21,CCO,331.0
Cn1c2ccccc2c2c(-c3ccc(O)cc3)c3oc4ccccc4c3cc21,CCO,330.0
Cn1c2ccccc2c2c(-c3ccc([N+](=O)[O-])cc3)c3oc4ccccc4c3cc21,CCO,315.0
Cn1c2ccccc2c2c(-c3ccc4ccccc4c3)c3oc4ccccc4c3cc21,CCO,331.0
Cn1c2ccccc2c2c(-c3cccc(Br)c3)c3oc4ccccc4c3cc21,CCO,331.0
Cn1c2ccccc2c2c(-c3ccccc3)c3oc4ccc(Cl)cc4c3cc21,CCO,334.0
Cn1c2ccccc2c2c(-c3ccccc3Br)c3oc4ccccc4c3cc21,CCO,331.0
Cn1c2ccccc2c2c3c(ccc21)ccc1c3c2cc(/C=C(\C#N)C(=O)O)ccc2n1C,ClC(Cl)Cl,435.0
Cn1c2ccccc2c2cc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)ccc21,CN(C)C=O,309.0
Cn1c2ccccc2c2cc(-c3cccc4c3Oc3c(-c5ccc6c(c5)c5ccccc5n6C)cccc3C4(C)C)ccc21,ClC(Cl)Cl,241.0
Cn1c2ccccc2c2cc(/C=C/C3=[O+][B-](F)(F)OC(/C=C/c4ccc5c(c4)c4ccccc4n5C)=C3c3ccccc3)ccc21,ClCCl,565.0
Cn1c2ccccc2c2cc(C=C(C#N)c3ccc(C=C4C(=O)NC(=O)NC4=O)s3)ccc21,ClC(Cl)Cl,524.0
Cn1c2ccccc2c2ccc(-c3cccc4c3Oc3c(-c5ccc6c7ccccc7n(C)c6c5)cccc3C4(C)C)cc21,ClC(Cl)Cl,262.0
Cn1c2ccccc2c2ccccc21,C1CCCCC1,347.0
Cn1c2nc(=O)[nH]c(=O)c-2nc2ccccc21,CC1CCCO1,459.0
Cn1cc(-c2nc3ccccc3nc2/C=C/N2CCCC2)c2ccccc21,CC#N,440.0
Cn1cc(-c2nc3ccccc3nc2C#Cc2ccc(C#N)cc2)c2ccccc21,ClCCl,418.0
Cn1cc(-c2nc3ccccc3nc2C#Cc2ccccc2)c2ccccc21,ClCCl,411.0
Cn1cc(/C=C/C(=O)c2ccccc2)c2ccccc21,CC#N,381.030445
Cn1cc(/C=C/C(=O)c2ccccc2)c2ccccc21,CO,391.7096019
Cn1cc(C=C(C#N)c2ccc(C=C(C#N)C(=O)O)s2)c2ccccc21,ClC(Cl)Cl,495.0
Cn1cc(C=C(C#N)c2ccc(C=C3SC(=S)N(CC(=O)O)C3=O)s2)c2ccccc21,ClC(Cl)Cl,511.0
Cn1cc(C=CC(=C(C#N)C#N)c2ccc(N)cc2)c2ccccc21,CO,441.0
Cn1ccc(-c2nc3ccccc3nc2/C=C/N2CCCC2)c1,CC#N,445.0
Cn1ccc(-n2cncn2)nc1=O,O,310.0
Cn1ccc(=O)n(C)c1=O,CC#N,264.0
Cn1cccc1-c1cc(C#N)ccc1C#N,C1CCOC1,370.0
Cn1cccc1-c1cc(C#N)ccc1C#N,CC#N,359.0
Cn1cccc1-c1cc(C#N)ccc1C#N,CCCCCC,366.0
Cn1cccc1-c1cc(C#N)ccc1C#N,CCCCOCCCC,370.0
Cn1cccc1-c1cc(C#N)ccc1C#N,CCOCC,364.0
Cn1cccc1-c1cc2sc(C=C(C#N)C(=O)O)cc2s1,CCO,364.0
Cn1cccc1-c1ccc(C#N)cc1,C1CCOC1,326.0
Cn1cccc1-c1ccc(C#N)cc1,CC#N,322.0
Cn1cccc1-c1ccc(C#N)cc1,CCCCCC,317.0
Cn1cccc1-c1ccc(C#N)cc1,CCCCOCCCC,321.0
Cn1cccc1-c1ccc(C#N)cc1,CCOCC,321.0
Cn1ccnc1,CC#N,246.0
Cn1nc(-c2ccc(C#N)cc2)cc1-c1ccccc1,ClCCl,282.0
Cn1nc(-c2ccc(C(F)(F)F)cc2)cc1-c1ccccc1,ClCCl,260.0
Cn1nc(-c2ccc(Cl)cc2)cc1-c1nc2ccc(Cl)cn2c1NC(C)(C)C,ClC(Cl)Cl,345.06
Cn1nc(-c2ccccc2)c2n[nH]nc2/c1=N\c1ccccn1,CC#N,402.0
Cn1nc(-c2ccccc2)c2n[nH]nc2/c1=N\c1ccccn1,CCO,382.0
Cn1nc(-c2ccccc2)c2n[nH]nc2/c1=N\c1ccccn1,Cc1ccccc1,410.0
Cn1nc(-c2ccccc2)c2nc3cc(Cl)ccc3nc21,C1CCCCC1,428.0
Cn1nc(-c2ccccc2)c2nc3cc(Cl)ccc3nc21,C1CCOC1,429.0
Cn1nc(-c2ccccc2)c2nc3cc(Cl)ccc3nc21,CC#N,427.0
Cn1nc(-c2ccccc2)c2nc3cc(F)ccc3nc21,C1CCCCC1,426.0
Cn1nc(-c2ccccc2)c2nc3cc(F)ccc3nc21,C1CCOC1,425.0
Cn1nc(-c2ccccc2)c2nc3cc(F)ccc3nc21,CC#N,424.0
Cn1nc(-c2ccccc2)cc1-c1ccccc1,ClCCl,254.0
Cn1nc(-c2nc3c(Cl)cc(Cl)cn3c2NC(C)(C)C)cc1-c1ccc(Cl)cc1,ClC(Cl)Cl,330.0
Cn1nc(-c2nc3ccc(Br)cn3c2NC(C)(C)C)cc1-c1ccc(Cl)cc1,ClC(Cl)Cl,328.92
Cn1nc(-c2nc3ccc(Cl)cn3c2NC(C)(C)C)cc1-c1ccc(Cl)cc1,ClC(Cl)Cl,328.86
Cn1nc(-c2nc3ccccn3c2NC(C)(C)C)cc1-c1ccc(Cl)cc1,ClC(Cl)Cl,317.3
Cn1nc2ccc(C=O)cc2c1-c1cc2ccccc2o1,CC#N,363.0
Cn1nc2ccc(C=O)cc2c1-c1cc2ccccc2o1,ClCCl,367.0
Cn1nc2ccc(C=O)cc2c1-c1ccc(CO)o1,CC#N,362.0
Cn1nc2ccc(C=O)cc2c1-c1ccc(CO)o1,ClCCl,364.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1cc2ccccc2s1,CC#N,384.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1cc2ccccc2s1,ClCCl,383.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1ccc(C=O)o1,CC#N,394.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1ccc(C=O)o1,ClCCl,394.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1ccn(Cc2ccccc2)c1,CC#N,402.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1ccn(Cc2ccccc2)c1,ClCCl,398.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1cn(C)c2ccccc12,CC#N,400.0
Cn1nc2ccc([N+](=O)[O-])cc2c1-c1cn(C)c2ccccc12,ClCCl,395.0
Cn1nc2ccccc2c1-c1cc2ccccc2o1,CC#N,342.0
Cn1nc2ccccc2c1-c1cc2ccccc2o1,ClCCl,345.0
Cn1nc2ccccc2c1-c1cc2ccccc2s1,CC#N,331.0
Cn1nc2ccccc2c1-c1cc2ccccc2s1,ClCCl,332.0
Cn1nc2ccccc2c1-c1ccc(C=C(C#N)C#N)o1,CC#N,450.0
Cn1nc2ccccc2c1-c1ccc(C=C(C#N)C#N)o1,ClCCl,462.0
Cn1nc2ccccc2c1-c1ccc(C=O)o1,CC#N,364.0
Cn1nc2ccccc2c1-c1ccc(C=O)o1,ClCCl,367.0
Cn1ncc2c3c(C#N)c4c5ccccc5n(C)c4nc3ccc21,CCOC(C)=O,383.0
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOc1nnc(Cl)nn1,ClCCl,519.0
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOc1nnc(Cl)nn1,OCC(F)(F)F,509.0
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOc1nnc(Cl)nn1,ClCCl,519.0
FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCOc1nnc(Cl)nn1,OCC(F)(F)F,519.0
FC(F)(F)C(F)(F)C(F)(F)C1=NC2=C(Br)C=C3c4cc(Br)c5nc(C(F)(F)C(F)(F)C(F)(F)F)nc6c(Br)cc(c4c56)=C4C=C(Br)C(=N1)C2C34,C1CCOC1,475.0
FC(F)(F)C(F)(F)C(F)(F)C1=NC2=C(Oc3ccccc3)C=C3c4cc(Oc5ccccc5)c5nc(C(F)(F)C(F)(F)C(F)(F)F)nc6c(Oc7ccccc7)cc(c4c56)=C4C=C(Oc5ccccc5)C(=N1)C2C34,C1CCOC1,498.0
FC(F)(F)C(F)(F)C(F)(F)C1=NC2=C(Sc3ccccc3)C=C3c4cc(Sc5ccccc5)c5nc(C(F)(F)C(F)(F)C(F)(F)F)nc6c(Sc7ccccc7)cc(c4c56)=C4C=C(Sc5ccccc5)C(=N1)C2C34,C1CCOC1,565.0
FC(F)(F)C(F)(F)C(F)(F)C1=NC2=C(c3ccccc3)C=C3c4cc(-c5ccccc5)c5nc(C(F)(F)C(F)(F)C(F)(F)F)nc6c(-c7ccccc7)cc(c4c56)=C4C=C(c5ccccc5)C(=N1)C2C34,C1CCOC1,500.0
FC(F)(F)C(F)(F)C(F)(F)c1nc2c(-c3ccsc3)cc3c4cc(-c5ccsc5)c5nc(C(F)(F)C(F)(F)C(F)(F)F)nc6c(-c7ccsc7)cc(c7cc(-c8ccsc8)c(n1)c2c37)c4c56,C1CCOC1,538.0
FC(F)(F)c1cc(-[n+]2nc3c(-c4ccccc4)cccc3c3ccccc32)cc(C(F)(F)F)c1,ClCCl,503.0
FC(F)(F)c1cc(-c2ccnc3nc(-c4ccccc4)nn23)cc(C(F)(F)F)c1,ClCCl,318.0
FC(F)(F)c1cc(-c2nc3nccc(-c4ccccc4)n3n2)cc(C(F)(F)F)c1,ClCCl,305.0
FC(F)(F)c1cc(-c2nc3ncccn3n2)cc(C(F)(F)F)c1,ClCCl,294.0
FC(F)(F)c1cc(-c2nnc3ccccn23)cc(C(F)(F)F)c1,ClCCl,298.0
FC(F)(F)c1cc(/N=N/c2cc3c4c(c2)CCCN4CCC3)cc(C(F)(F)F)c1,CCOC(C)=O,486.0
FC(F)(F)c1cc2c3c([n+]4c(-c5ccccc5)c(-c5ccccc5)c5ccccc5c4c(-c4ccccc4)c3c1)OC(c1ccccc1)=C2c1ccccc1,ClCCl,518.0
FC(F)(F)c1cc2n(n1)[B-](c1ccccc1)(c1ccccc1)[n+]1ccc3ccccc3c1-2,C1CCCCC1,379.0
FC(F)(F)c1cc2n(n1)[B-](c1ccccc1)(c1ccccc1)[n+]1ccc3ccccc3c1-2,Cc1ccccc1,377.0
FC(F)(F)c1cc2n(n1)[B-](c1ccccc1)(c1ccccc1)[n+]1ccc3ccccc3c1-2,ClCCl,373.0
FC(F)(F)c1cc2n(n1)[B-]1(c3ccccc3-c3ccccc31)[n+]1ccc3ccccc3c1-2,C1CCCCC1,373.0
FC(F)(F)c1cc2n(n1)[B-]1(c3ccccc3-c3ccccc31)[n+]1ccc3ccccc3c1-2,Cc1ccccc1,375.0
FC(F)(F)c1cc2n(n1)[B-]1(c3ccccc3-c3ccccc31)[n+]1ccc3ccccc3c1-2,ClCCl,373.0
FC(F)(F)c1ccc(-c2[o+]c3c(-c4ccc(C(F)(F)F)cc4)c(-c4ccc(C(F)(F)F)cc4)c4cccc5ccc(c2-c2ccc(C(F)(F)F)cc2)c3c54)cc1,ClCCl,477.0
FC(F)(F)c1ccc(-c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,ClCCl,289.0
FC(F)(F)c1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3)n3ccccc23)cc1,ClC(Cl)Cl,325.0
FC(F)(F)c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClC(Cl)Cl,327.0
FC(F)(F)c1ccc(-c2ncc3ccccn23)cc1,ClC(Cl)Cl,340.0
FC(F)(F)c1ccc(-c2nnc(-c3cc(-c4nnc(-c5ccc(C(F)(F)F)cc5)o4)c(-n4c5ccccc5c5ccccc54)cc3-n3c4ccccc4c4ccccc43)o2)cc1,Cc1ccccc1,376.0
FC(F)(F)c1ccc(-c2pc3ccccc3s2)cc1,CC#N,331.0
FC(F)(F)c1ccc(-n2c(-c3ccc(N(c4ccc(-c5ccc(N(c6ccc(-c7nc8c9ccccc9c9ccccc9c8n7-c7ccc(C(F)(F)F)cc7)cc6)c6ccc(-c7nc8c9ccccc9c9ccccc9c8n7-c7ccc(C(F)(F)F)cc7)cc6)cc5)cc4)c4ccc(-c5nc6c7ccccc7c7ccccc7c6n5-c5ccc(C(F)(F)F)cc5)cc4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,ClCCl,376.0
FC(F)(F)c1ccc(/C2=C3/N=C(C(c4ccccc4)=C3c3ccccc3)/C(c3ccc(C(F)(F)F)cc3)=c3\[nH]/c(c(-c4ccccc4)c3-c3ccccc3)=C(/c3ccc(C(F)(F)F)cc3)C3=N/C(=C(/c4ccc(C(F)(F)F)cc4)c4[nH]c2c(-c2ccccc2)c4-c2ccccc2)C(c2ccccc2)=C3c2ccccc2)cc1,ClCCl,708.0
FC(F)(F)c1ccc(/C=C/c2nc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1,ClCCl,430.0
FC(F)(F)c1ccc(/N=N/c2cc3c4c(c2)CCCN4CCC3)cc1,CCOC(C)=O,466.0
FC(F)(F)c1ccc(B2c3ccccc3Nc3ccccc32)c(C(F)(F)F)c1,ClCCl,388.0
FC(F)(F)c1ccc(C#Cc2cc(C#Cc3ccc(C(F)(F)F)cc3)c3ccc4c(C#Cc5ccc(C(F)(F)F)cc5)cc(C#Cc5ccc(C(F)(F)F)cc5)c5ccc2c3c54)cc1,ClCCl,467.0
FC(F)(F)c1ccc(C#Cc2ncc(-c3ccccc3)o2)cc1,ClCCl,320.0
FC(F)(F)c1ccc(C2=C(c3ccc(C(F)(F)F)cc3)c3ccccc3B3Nc4ccccc4C=C32)cc1,ClCCl,381.0
FC(F)(F)c1ccc(C2=CC3=c4cc(-c5ccc(C(F)(F)F)cc5)c5nc(C(F)(F)C(F)(F)C(F)(F)F)nc6c(-c7ccc(C(F)(F)F)cc7)cc(c4c65)C4=CC(c5ccc(C(F)(F)F)cc5)=C5N=C(C(F)(F)C(F)(F)C(F)(F)F)N=C2C5C43)cc1,C1CCOC1,489.0
FC(F)(F)c1ccc(C=Cc2ccc3c4c(ccc3c2)OC(c2ccccc2)(c2ccccc2)C4=C=C(c2ccccc2)c2ccccc2)cc1,C1CCOC1,458.0
FC(F)(F)c1ccc(NC(=S)NCc2c3ccccc3cc3ccccc23)cc1,CS(C)=O,430.0
FC(F)(F)c1ccc2c(c1)CC1Oc3ccccc3CN21,CC#N,205.0
FC(F)(F)c1ccc2c(c1)Nc1ccccc1S2,CC#N,322.0
FC(F)(F)c1ccc2c(c1)Nc1ccccc1S2,CO,324.0
FC(F)(F)c1ccc2c(c1)c(-c1ccccc1)c(-c1ccccc1)[n+]1c3ccccc3c(-c3ccccc3)c(-c3ccccc3)c21,ClCCl,462.0
FC(F)(F)c1ccc2c3ccccc3c3nc4ccccc4n3c2c1,CC#N,328.0
FC(F)(F)c1ccc2oc3nc4oc5ccc(N(c6ccccc6)c6ccccc6)cc5c4cc3c2c1,ClC(Cl)Cl,345.0
FC(F)(F)c1ccc2oc3nc4oc5ccc(N6c7ccccc7Oc7ccccc76)cc5c4cc3c2c1,ClC(Cl)Cl,344.0
FC(F)(F)c1cccc2c3ccccc3n3c4ccccc4nc3c12,CC#N,341.0
FC(F)(F)c1ccccc1B1c2ccccc2N(c2ccccc2)c2ccccc21,ClCCl,389.0
FC(F)(F)c1ccccc1B1c2ccccc2Nc2ccccc21,ClCCl,386.0
FP(F)(c1c2ccccc2cc2ccccc12)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,C1CCOC1,401.0
FS(F)(F)(F)(F)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CC(C)=O,344.0
FS(F)(F)(F)(F)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,Cc1ccccc1,349.0
FS(F)(F)(F)(F)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,347.0
FS(F)(F)(F)(F)c1ccc(/C=C/c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1,CC(C)=O,397.0
FS(F)(F)(F)(F)c1ccc(/C=C/c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1,Cc1ccccc1,407.0
FS(F)(F)(F)(F)c1ccc(/C=C/c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1,ClCCl,403.0
FS(F)(F)(F)(F)c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CC(C)=O,381.0
FS(F)(F)(F)(F)c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,Cc1ccccc1,385.0
FS(F)(F)(F)(F)c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,386.0
FS(F)(F)(F)(F)c1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CC(C)=O,363.0
FS(F)(F)(F)(F)c1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,Cc1ccccc1,369.0
FS(F)(F)(F)(F)c1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,368.0
F[B-](F)(F)F,C1COCCO1,532.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,C1CCCCC1,442.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,C1CCOC1,425.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,CC#N,412.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,CC(C)=O,422.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,CCO,418.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,CCOC(C)=O,427.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,CO,417.0
F[B-]1(F)N(c2ccccc2)C=Cc2cccc[n+]21,O,396.0
F[B-]1(F)N(c2ccccc2)c2cccc3ccc4ccc[n+]1c4c23,ClCCl,465.0
F[B-]1(F)N2C(=Nc3cccc4cccc2c34)c2cccc[n+]21,CC#N,350.0
F[B-]1(F)N2C(=Nc3cccc4cccc2c34)c2cccc[n+]21,CO,348.0
F[B-]1(F)N2C(=Nc3cccc4cccc2c34)c2cccc[n+]21,CS(C)=O,351.0
F[B-]1(F)N2C(=Nc3cccc4cccc2c34)c2cccc[n+]21,Cc1ccccc1,354.0
F[B-]1(F)N2C=C(Br)C=CC2=N/[N+]1=C/c1ccc(-c2cccs2)cc1,CO,482.0
F[B-]1(F)N2C=C(Br)C=CC2=N/[N+]1=C/c1cccs1,CO,471.0
F[B-]1(F)N2C=C(Cl)C=CC2=N/[N+]1=C/c1ccc(-c2cccs2)cc1,CO,491.0
F[B-]1(F)N2C=C(I)C=CC2=N/[N+]1=C/c1ccc(-c2cccs2)cc1,CO,490.0
F[B-]1(F)N2C=C(n3cc(-c4ccccc4)nn3)C=CC2=N/[N+]1=C/c1ccc(-c2cccs2)cc1,CO,491.0
F[B-]1(F)N2C=CC=CC2=N/[N+]1=C/c1ccc(-c2cccs2)cc1,CO,472.0
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,C1CCCCC1,397.6
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,C1CCOC1,396.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,C1COCCO1,396.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CC#N,393.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CC(=O)N(C)C,396.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CC(C)=O,394.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCC(C)C,396.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCC(C)=O,396.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCCCC,396.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCCCCCCCCO,387.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCCCCCCO,386.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCCCCO,386.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCCO,385.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCCOC(C)=O,396.0
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCCO,385.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCO,385.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCOC(C)=O,395.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CCOCC,395.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CN(C)C=O,396.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CN1CCCC1=O,397.0
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CNC=O,392.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CO,384.0
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,COC(C)=O,394.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,COC=O,393.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,CS(C)=O,396.8
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,Cc1ccccc1,398.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,ClC(Cl)(Cl)Cl,397.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,ClC(Cl)Cl,392.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,ClCCl,393.2
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,NC=O,389.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,OCC(F)(F)F,377.4
F[B-]1(F)N2C=CC=CC2=Nc2cccc[n+]21,OCCO,385.2
F[B-]1(F)N2C=CN=CC2=[N+]2[N+]1=Cc1c(-c3ccccc3)cc(-c3cccs3)n1[B-]2(F)F,ClCCl,533.0
F[B-]1(F)OC(/C=C/c2ccccc2)=CC(c2ccccc2)=[O+]1,ClCCl,398.0
F[B-]1(F)OC(C#Cc2ccccc2)=CC(c2ccccc2)=[O+]1,ClCCl,401.0
F[B-]1(F)OC(c2cc3c4c(c2)CCCN4CCC3)=Cc2cccc[n+]21,ClC(Cl)Cl,450.0
F[B-]1(F)OC(c2ccc(Br)cc2)=Cc2c3ccccc3c3ccccc3[n+]21,ClC(Cl)Cl,435.0
F[B-]1(F)OC(c2ccc(Br)cc2)=Cc2c3ccccc3cc[n+]21,ClC(Cl)Cl,403.0
F[B-]1(F)OC(c2ccc(Br)cc2)=Cc2ccc3ccccc3[n+]21,ClC(Cl)Cl,430.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2c3ccccc3c3ccccc3[n+]21,ClC(Cl)Cl,430.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2c3ccccc3cc[n+]21,ClC(Cl)Cl,398.5
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2cc(Cl)nc[n+]21,C1CCOC1,371.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2cc(Cl)nc[n+]21,CC#N,368.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2cc(Cl)nc[n+]21,CCCCCC,370.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2cc(Cl)nc[n+]21,Cc1ccccc1,374.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2cc(Cl)nc[n+]21,ClC(Cl)Cl,372.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2cc(Cl)nc[n+]21,ClCCl,372.0
F[B-]1(F)OC(c2ccc(C(F)(F)F)cc2)=Cc2ccc3ccccc3[n+]21,ClC(Cl)Cl,424.0
F[B-]1(F)OC(c2ccc(N3CCCC3)cc2)=Cc2cccc[n+]21,ClC(Cl)Cl,438.0
F[B-]1(F)OC(c2ccc(N3CCCCC3)cc2)=Cc2cccc[n+]21,ClC(Cl)Cl,421.0
F[B-]1(F)OC(c2ccc3ccccc3c2)=CC(c2ccc3ccccc3c2)=[O+]1,CC#N,419.0
F[B-]1(F)OC(c2ccc3ccccc3c2)=CC(c2ccc3ccccc3c2)=[O+]1,ClC(Cl)(Cl)Cl,412.0
F[B-]1(F)OC(c2cccc(Br)c2)=Cc2c3ccccc3c3ccccc3[n+]21,ClC(Cl)Cl,432.0
F[B-]1(F)OC(c2cccc(Br)c2)=Cc2ccc3ccccc3[n+]21,ClC(Cl)Cl,426.0
F[B-]1(F)OC(c2ccccc2)=C(c2ccccc2)c2oc3ccccc3[n+]21,C1CCOC1,344.0
F[B-]1(F)OC(c2ccccc2)=CC(c2ccccc2)=[O+]1,CC#N,376.0
F[B-]1(F)OC(c2ccccc2)=CC(c2ccccc2)=[O+]1,ClC(Cl)(Cl)Cl,375.0
F[B-]1(F)OC(c2ccccc2)=Cc2c3ccccc3c3ccccc3[n+]21,ClC(Cl)Cl,432.0
F[B-]1(F)OC(c2ccccc2)=Cc2c3ccccc3cc[n+]21,ClC(Cl)Cl,400.0
F[B-]1(F)OC(c2ccccc2)=Cc2cc(Cl)nc[n+]21,C1CCOC1,374.0
F[B-]1(F)OC(c2ccccc2)=Cc2cc(Cl)nc[n+]21,CC#N,371.0
F[B-]1(F)OC(c2ccccc2)=Cc2cc(Cl)nc[n+]21,CCCCCC,373.0
F[B-]1(F)OC(c2ccccc2)=Cc2cc(Cl)nc[n+]21,Cc1ccccc1,377.0
F[B-]1(F)OC(c2ccccc2)=Cc2cc(Cl)nc[n+]21,ClC(Cl)Cl,376.0
F[B-]1(F)OC(c2ccccc2)=Cc2cc(Cl)nc[n+]21,ClCCl,375.0
F[B-]1(F)OC(c2ccccc2)=Cc2cc3[n+](c[n+]21)[B-](F)(F)OC(c1ccccc1)=C3,ClCCl,475.0
F[B-]1(F)OC(c2ccccc2)=Cc2ccc3ccccc3[n+]21,ClC(Cl)Cl,427.0
F[B-]1(F)OC(c2ccccc2)=Cc2ccc3ccccc3[n+]21,ClCCl,426.0
F[B-]1(F)OC(c2ccccc2)=Cc2cccc[n+]21,ClCCl,397.0
F[B-]1(F)OC(c2ccccc2)=Nc2sc(-c3ccccc3)n[n+]21,C1CCOC1,332.0
F[B-]1(F)OC(c2ccccc2)=Nc2sc(-c3ccccc3)n[n+]21,CC#N,330.0
F[B-]1(F)OC(c2ccccc2)=Nc2sc(-c3ccccc3)n[n+]21,CCO,328.0
F[B-]1(F)OC(c2ccccc2)=Nc2sc(-c3ccccc3)n[n+]21,CCOC(C)=O,331.0
F[B-]1(F)OC(c2ccccc2)=Nc2sc(-c3ccccc3)n[n+]21,Cc1ccccc1,337.0
F[B-]1(F)OC(c2ccccc2)=Nc2sc(-c3ccccc3)n[n+]21,ClC(Cl)Cl,335.0
F[B-]1(F)OC(c2ccccc2)=Nc2sc(-c3ccccc3)n[n+]21,ClCCl,333.0
F[B-]1(F)Oc2c(-c3cccc4c3O[B-](F)(F)[n+]3c(-c5ccccc5)c(-c5ccccc5)n(-c5ccc(C(F)(F)F)cc5)c3-4)cccc2-c2n(-c3ccc(C(F)(F)F)cc3)c(-c3ccccc3)c(-c3ccccc3)[n+]21,C1CCOC1,342.0
F[B-]1(F)Oc2c(ccc3c4c(ccc23)C=[N+](c2ccccc2)[B-](F)(F)O4)C=[N+]1c1ccccc1,Cc1ccccc1,497.0
F[B-]1(F)Oc2c(ccc3c4c(ccc23)C=[N+](c2ccccc2)[B-](F)(F)O4)C=[N+]1c1ccccc1,ClCCl,485.0
F[B-]1(F)Oc2ccc(Br)cc2-c2c3c(c4c([n+]21)CCc1ccccc1-4)CCc1ccccc1-3,ClCCl,347.0
F[B-]1(F)Oc2ccc3ccccc3c2-c2c3c(c4c([n+]21)CCc1ccccc1-4)CCc1ccccc1-3,ClCCl,346.0
F[B-]1(F)Oc2ccccc2-c2c3c(c4c([n+]21)CCc1ccccc1-4)CCc1ccccc1-3,ClCCl,347.0
F[B-]1(F)Oc2ccccc2-c2cc(-n3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc43)cc[n+]21,Cc1ccccc1,374.0
F[B-]1(F)Oc2ccccc2-c2cc(-n3c4ccccc4c4ccccc43)cc[n+]21,Cc1ccccc1,366.0
F[B-]1(F)Oc2ccccc2-c2cnc3ccccc3[n+]21,Cc1ccccc1,407.0
F[B-]1(F)Oc2ccccc2-c2n(-c3ccc(C(F)(F)F)cc3)c(-c3ccccc3)c(-c3ccccc3)[n+]21,C1CCOC1,327.0
F[B-]1(F)Oc2ccccc2-c2nc(-c3ccccc3)c3cc(Cl)ccc3[n+]21,Cc1ccccc1,395.0
F[B-]1(F)[O+]=c2c(c3ccccc3n2Cc2ccccc2)=NN1c1ccccc1,C1CCOC1,437.0
F[B-]1(F)n2c(-c3ccc(Br)cc3)cc(-c3ccccc3)c2N=C2C(c3ccccc3)=CC(c3ccc(Br)cc3)=[N+]21,ClC(Cl)Cl,658.0
F[B-]1(F)n2c(-c3ccccc3)cc(-c3ccccc3)c2C(c2ccccc2)=C2C(c3ccccc3)=CC(c3ccccc3)=[N+]21,C1CCOC1,561.0
F[B-]1(F)n2c(-c3ccccc3)cc(-c3ccccc3)c2C=C2C(c3ccccc3)=CC(c3ccccc3)=[N+]21,C1CCOC1,571.0
F[B-]1(F)n2c(-c3ccccc3)cc(-c3ccccc3)c2N=C2C(c3ccccc3)=CC(c3ccccc3)=[N+]21,CC#N,643.0
F[B-]1(F)n2c(-c3ccccc3)cc(-c3ccccc3)c2N=C2C(c3ccccc3)=CC(c3ccccc3)=[N+]21,ClC(Cl)Cl,650.0
F[B-]1(F)n2c(-c3ccccc3)cc(-c3ccccn3)c2N=C2C(c3ccccn3)=CC(c3ccccc3)=[N+]21,CC#N,655.0
F[B-]1(F)n2c(-c3ccccc3)cnc2-c2cccc[n+]21,C1CCCCC1,412.0
F[B-]1(F)n2c(-c3ccccc3)cnc2-c2cccc[n+]21,C1CCOC1,394.0
F[B-]1(F)n2c(-c3ccccc3)cnc2-c2cccc[n+]21,C1COCCO1,394.0
F[B-]1(F)n2c(-c3ccccc3)cnc2-c2cccc[n+]21,CC#N,384.0
F[B-]1(F)n2c(-c3ccccc3)cnc2-c2cccc[n+]21,CCCCCC,412.0
F[B-]1(F)n2c(-c3ccccc3)cnc2-c2cccc[n+]21,CO,382.0
F[B-]1(F)n2c(-c3ccccc3)cnc2-c2cccc[n+]21,ClC(Cl)Cl,369.0
F[B-]1(F)n2c(-c3cccs3)cc(-c3ccccc3)c2N=C2C(c3ccccc3)=CC(c3cccs3)=[N+]21,CC#N,710.0
F[B-]1(F)n2c(-c3cccs3)cc(-c3ccccc3)c2N=C2C(c3ccccc3)=CC(c3cccs3)=[N+]21,ClCCl,718.0
F[B-]1(F)n2c(-c3cccs3)cc(-c3cccs3)c2N=C2C(c3cccs3)=CC(c3cccs3)=[N+]21,C1CCOC1,740.0
F[B-]1(F)n2c(-c3cccs3)cc(-c3cccs3)c2N=C2C(c3cccs3)=CC(c3cccs3)=[N+]21,CC#N,733.0
F[B-]1(F)n2c(-c3cccs3)cc(-c3cccs3)c2N=C2C(c3cccs3)=CC(c3cccs3)=[N+]21,CS(C)=O,752.0
F[B-]1(F)n2c(-c3cccs3)cc(-c3cccs3)c2N=C2C(c3cccs3)=CC(c3cccs3)=[N+]21,Cc1ccccc1,743.0
F[B-]1(F)n2c(-c3cccs3)cc(-c3cccs3)c2N=C2C(c3cccs3)=CC(c3cccs3)=[N+]21,ClCCl,741.0
F[B-]1(F)n2c(/C=C/c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)ccc2C(c2ccc(C(=C(c3ccccc3)c3ccccc3)c3ccccc3)cc2)=C2C=CC(/C=C/c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)=[N+]21,C1CCOC1,666.0
F[B-]1(F)n2c(Cl)c(Cl)c(Br)c2C(Cl)=C2C(Br)=C(Cl)C(Cl)=[N+]21,ClCCl,546.0
F[B-]1(F)n2c(Cl)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CC#N,479.0
F[B-]1(F)n2c(Cl)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CCCCCC,523.0
F[B-]1(F)n2c(Cl)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CCOC(C)=O,497.0
F[B-]1(F)n2c(Cl)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CO,488.0
F[B-]1(F)n2c(Cl)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,ClCCl,505.0
F[B-]1(F)n2c(NCc3ccccc3)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CC#N,578.0
F[B-]1(F)n2c(NCc3ccccc3)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CCCCCC,581.0
F[B-]1(F)n2c(NCc3ccccc3)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CCOC(C)=O,580.0
F[B-]1(F)n2c(NCc3ccccc3)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,CO,579.0
F[B-]1(F)n2c(NCc3ccccc3)ccc2C(c2c(Cl)cccc2Cl)=C2C=CC(NCc3ccccc3)=[N+]21,ClCCl,581.0
F[B-]1(F)n2c(Nc3cccc4cccnc34)ccc2C(c2ccccc2)=C2C=CC(Cl)=[N+]21,C1CCCCC1,560.0
F[B-]1(F)n2c(Nc3cccc4cccnc34)ccc2C(c2ccccc2)=C2C=CC(Cl)=[N+]21,CC#N,547.0
F[B-]1(F)n2c(Nc3cccc4cccnc34)ccc2C(c2ccccc2)=C2C=CC(Cl)=[N+]21,Cc1ccccc1,561.0
F[B-]1(F)n2c(Nc3cccc4cccnc34)ccc2C(c2ccccc2)=C2C=CC(Cl)=[N+]21,ClC(Cl)Cl,555.0
F[B-]1(F)n2c(Oc3ccccc3)c(Cl)c(Br)c2C(Oc2ccccc2)=C2C(Br)=C(Cl)C(Oc3ccccc3)=[N+]21,ClCCl,533.0
F[B-]1(F)n2c(Oc3ccccc3)c(Cl)c3c2C(=C2C(Br)=C(Cl)C(Oc4ccccc4)=[N+]21)Oc1ccccc1-3,ClCCl,472.0
F[B-]1(F)n2c(c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)C(c2ccccc2)=C2C(c3ccccc3)=C(c3ccccc3)C(c3ccccc3)=[N+]21,C1CCOC1,573.0
F[B-]1(F)n2c(c(-c3ccccc3)c(-c3ccccc3)c2-c2ccccc2)C=C2C(c3ccccc3)=C(c3ccccc3)C(c3ccccc3)=[N+]21,C1CCOC1,576.0
F[B-]1(F)n2c(c(-c3ccccc3)c(-c3cccs3)c2-c2ccccc2)N=C2C(c3ccccc3)=C(c3cccs3)C(c3ccccc3)=[N+]21,ClCCl,650.0
F[B-]1(F)n2c(c(-c3ccccc3)c3c2C2=Cc4ccccc4OC2CC3)C=C2C(c3ccccc3)=C3CCC4Oc5ccccc5C=C4C3=[N+]21,ClC(Cl)Cl,732.0
F[B-]1(F)n2c(c(-c3ccccc3)c3ccccc32)C(c2ccccc2)=C2C(c3ccccc3)=c3ccccc3=[N+]21,ClCCl,568.0
F[B-]1(F)n2c(c(-c3cccs3)c3c2-c2ccccc2CC3)C=C2C(c3cccs3)=C3CCc4ccccc4C3=[N+]21,CC#N,636.0
F[B-]1(F)n2c(c(Sc3ccccc3)c3c2-c2ccccc2CC3)C=C2C(Sc3ccccc3)=C3CCc4ccccc4C3=[N+]21,CC#N,640.0
F[B-]1(F)n2c(c3c(c2-c2ccccc2)C2C=CC3CC2)C(c2ccccc2)=C2C3=C(C(c4ccccc4)=[N+]21)C1C=CC3CC1,ClCCl,558.0
F[B-]1(F)n2c(c3cc4ccccc4cc3c2-c2ccccc2)C=C2c3cc4ccccc4cc3C(c3ccccc3)=[N+]21,C1CCOC1,761.0
F[B-]1(F)n2c(c3cc4ccccc4cc3c2-c2ccccc2)C=C2c3cc4ccccc4cc3C(c3ccccc3)=[N+]21,CN(C)C=O,764.0
F[B-]1(F)n2c(c3cc4ccccc4cc3c2-c2ccccc2)C=C2c3cc4ccccc4cc3C(c3ccccc3)=[N+]21,ClCCl,762.0
F[B-]1(F)n2c(c3cc4ccccc4cc3c2-c2ccccc2)C=C2c3cc4ccccc4cc3C(c3ccccc3)=[N+]21,c1ccccc1,765.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2ccc3ccccc3[n+]21,C1CCOC1,486.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2ccc3ccccc3[n+]21,CC#N,481.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2ccc3ccccc3[n+]21,CCCCCC,490.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2ccc3ccccc3[n+]21,Cc1ccccc1,490.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2ccc3ccccc3[n+]21,ClCCl,455.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2cccc(Cl)[n+]21,C1CCOC1,476.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2cccc(Cl)[n+]21,CC#N,470.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2cccc(Cl)[n+]21,CCCCCC,481.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2cccc(Cl)[n+]21,Cc1ccccc1,481.0
F[B-]1(F)n2c(c3cccc4cccc2c43)=Nc2cccc(Cl)[n+]21,ClCCl,447.0
F[B-]1(F)n2c(c3ccccc3c2-c2ccccc2)N=C2c3ccccc3C(c3ccccc3)=[N+]21,ClCCl,712.0
F[B-]1(F)n2c(cc(-c3cccs3)c2-c2ccccc2)C(c2ccccc2)=C2C=C(c3cccs3)C(c3ccccc3)=[N+]21,C1CCOC1,620.0
F[B-]1(F)n2c(cc(-c3cccs3)c2-c2ccccc2)C(c2ccccc2)=C2C=C(c3cccs3)C(c3ccccc3)=[N+]21,CC#N,613.0
F[B-]1(F)n2c(cc(-c3cccs3)c2-c2ccccc2)C(c2ccccc2)=C2C=C(c3cccs3)C(c3ccccc3)=[N+]21,Cc1ccccc1,628.0
F[B-]1(F)n2c(cc(Br)c2Br)C(c2ccccc2)=C2C=C(Br)C(c3ccc[nH]3)=[N+]21,ClC(Cl)Cl,626.0
F[B-]1(F)n2c(cc(Cl)c2-c2ccccc2)C(c2ccccc2)=C2C=C(Cl)C(c3ccccc3)=[N+]21,C1CCOC1,566.0
F[B-]1(F)n2c(cc(Cl)c2-c2ccccc2)C(c2ccccc2)=C2C=C(Cl)C(c3ccccc3)=[N+]21,CC#N,558.0
F[B-]1(F)n2c(cc(Cl)c2-c2ccccc2)C(c2ccccc2)=C2C=C(Cl)C(c3ccccc3)=[N+]21,Cc1ccccc1,572.0
F[B-]1(F)n2c(cc3c2-c2ccccc2CC3)C(c2ccc(I)cc2)=C2C=C3CCc4ccccc4C3=[N+]21,ClC(Cl)Cl,634.0
F[B-]1(F)n2c(cc3c4ccccc4[nH]c32)C(c2ccccc2)=C2C=c3c([nH]c4ccccc34)=[N+]21,ClCCl,607.0
F[B-]1(F)n2c(cc3c4ccccc4c4ccccc4c32)-c2ccc3ccccc3[n+]21,ClCCl,476.0
F[B-]1(F)n2c(cc3c4ccccc4oc32)C(c2ccccc2)=C2C=c3c(oc4ccccc34)=[N+]21,C1CCCCC1,586.0
F[B-]1(F)n2c(cc3c4ccccc4oc32)C(c2ccccc2)=C2C=c3c(oc4ccccc34)=[N+]21,CCOC(C)=O,581.0
F[B-]1(F)n2c(cc3c4ccccc4oc32)C(c2ccccc2)=C2C=c3c(oc4ccccc34)=[N+]21,CO,579.0
F[B-]1(F)n2c(cc3ccc4ccccc4c32)C(c2ccc(I)cc2)=C2C=C3CCc4ccccc4C3=[N+]21,ClC(Cl)Cl,634.0
F[B-]1(F)n2c(cc3oc(-c4ccccc4)cc32)C=C2C=c3oc(-c4ccccc4)cc3=[N+]21,ClC(Cl)Cl,652.0
F[B-]1(F)n2c(cc3oc4ccccc4c32)C(c2ccc(I)cc2)=C2C=c3oc4ccccc4c3=[N+]21,ClC(Cl)Cl,637.0
F[B-]1(F)n2c(cc3sc4ccccc4c32)C(c2ccc(I)cc2)=C2C=c3sc4ccccc4c3=[N+]21,ClC(Cl)Cl,658.0
F[B-]1(F)n2c(ccc2-c2ccccc2)C(C(F)(F)F)=C2C=CC(c3ccccc3)=[N+]21,CCCCCC,592.0
F[B-]1(F)n2c(ccc2-c2ccccc2)C(c2ccc(I)cc2)=C2C=CC(c3ccccc3)=[N+]21,ClC(Cl)Cl,555.0
F[B-]1(F)n2c(ccc2-c2nc3ccccc3s2)C(c2ccccc2)=C2C=CC(c3nc4ccccc4s3)=[N+]21,ClC(Cl)Cl,623.0
F[B-]1(F)n2c(ccc2-n2cccn2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=C2C=CC(n3cccn3)=[N+]21,ClCCl,571.0
F[B-]1(F)n2c(ccc2-n2cccn2)C(c2cccnc2)=C2C=CC(n3cccn3)=[N+]21,ClCCl,565.0
F[B-]1(F)n2c(ccc2-n2cccn2)C(c2cccs2)=C2C=CC(n3cccn3)=[N+]21,ClCCl,571.0
F[B-]1(F)n2c(ccc2-n2cccn2)C=C2C=CC(n3cccn3)=[N+]21,ClCCl,562.0
F[B-]1(F)n2c(ccc2N2CCOCC2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=C2C=CC=[N+]21,ClCCl,491.0
F[B-]1(F)n2c(ccc2N2CCOCC2)C(c2ccccc2)=C2C=CC(N3CCOCC3)=[N+]21,CC#N,566.0
F[B-]1(F)n2c(ccc2N2CCOCC2)C(c2ccccc2)=C2C=CC(N3CCOCC3)=[N+]21,CCCCCC,573.0
F[B-]1(F)n2c(ccc2N2CCOCC2)C(c2ccccc2)=C2C=CC(N3CCOCC3)=[N+]21,CCOC(C)=O,570.0
F[B-]1(F)n2c(ccc2N2CCOCC2)C(c2ccccc2)=C2C=CC(N3CCOCC3)=[N+]21,CO,561.0
F[B-]1(F)n2c(ccc2N2CCOCC2)C(c2ccccc2)=C2C=CC(N3CCOCC3)=[N+]21,ClCCl,572.0
F[B-]1(F)n2c(ccc2N2CCOCC2)C(c2cccnc2)=C2C=CC=[N+]21,ClCCl,487.0
F[B-]1(F)n2c(nc(Br)c2Br)-c2cccc[n+]21,C1CCCCC1,392.0
F[B-]1(F)n2c(nc(Br)c2Br)-c2cccc[n+]21,C1CCOC1,366.0
F[B-]1(F)n2c(nc(Br)c2Br)-c2cccc[n+]21,C1COCCO1,366.0
F[B-]1(F)n2c(nc(Br)c2Br)-c2cccc[n+]21,CC#N,356.0
F[B-]1(F)n2c(nc(Br)c2Br)-c2cccc[n+]21,CCCCCC,393.0
F[B-]1(F)n2c(nc(Br)c2Br)-c2cccc[n+]21,CO,357.0
F[B-]1(F)n2c(nc(Br)c2Br)-c2cccc[n+]21,ClC(Cl)Cl,374.0
F[B-]1(F)n2c(nc3c4ccccc4c4ccccc4c32)-c2ccc3ccccc3[n+]21,ClCCl,476.0
F[B-]1(F)n2c(nc3c4ccccc4c4ccccc4c32)-c2cccc[n+]21,CC#N,403.0
F[B-]1(F)n2c(nc3c4ccccc4c4ccccc4c32)-c2cccc[n+]21,CCCCCC,447.0
F[B-]1(F)n2c(nc3c4ccccc4c4ccccc4c32)-c2cccc[n+]21,CO,404.0
F[B-]1(F)n2c(nc3c4ccccc4c4ccccc4c32)-c2cccc[n+]21,ClC(Cl)Cl,430.0
F[B-]1(F)n2c(nc3c4ccccc4c4ccccc4c32)-c2cccc[n+]21,ClCCl,421.0
F[B-]1(F)n2cccc2C(c2c3ccccc3c(-c3ccccc3)c3ccccc23)=C2C=CC=[N+]21,CC#N,502.0
F[B-]1(F)n2cccc2C(c2c3ccccc3c(-c3ccccc3)c3ccccc23)=C2C=CC=[N+]21,CCCCCC,509.0
F[B-]1(F)n2cccc2C(c2c3ccccc3c(-c3ccccc3)c3ccccc23)=C2C=CC=[N+]21,CCO,504.0
F[B-]1(F)n2cccc2C(c2c3ccccc3c(-c3ccccc3)c3ccccc23)=C2C=CC=[N+]21,CN(C)C=O,506.0
F[B-]1(F)n2cccc2C(c2c3ccccc3c(-c3ccccc3)c3ccccc23)=C2C=CC=[N+]21,Cc1ccccc1,509.0
F[B-]1(F)n2cccc2C(c2c3ccccc3c(-c3ccccc3)c3ccccc23)=C2C=CC=[N+]21,ClCCl,506.0
F[B-]1(F)n2cccc2C(c2c3ccccc3cc3ccccc23)=C2C=CC=[N+]21,CC#N,502.0
F[B-]1(F)n2cccc2C(c2c3ccccc3cc3ccccc23)=C2C=CC=[N+]21,CCCCCC,505.0
F[B-]1(F)n2cccc2C(c2c3ccccc3cc3ccccc23)=C2C=CC=[N+]21,CCO,503.0
F[B-]1(F)n2cccc2C(c2c3ccccc3cc3ccccc23)=C2C=CC=[N+]21,CN(C)C=O,506.0
F[B-]1(F)n2cccc2C(c2c3ccccc3cc3ccccc23)=C2C=CC=[N+]21,Cc1ccccc1,508.0
F[B-]1(F)n2cccc2C(c2c3ccccc3cc3ccccc23)=C2C=CC=[N+]21,ClCCl,506.0
F[B-]1(F)n2cccc2C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=C2C=CC(N3CCOCC3)=[N+]21,ClCCl,491.0
F[B-]1(F)n2cccc2C(c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc2)=C2C=CC=[N+]21,CC#N,498.0
F[B-]1(F)n2cccc2C(c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc2)=C2C=CC=[N+]21,CCCCCC,501.0
F[B-]1(F)n2cccc2C(c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc2)=C2C=CC=[N+]21,CCO,500.0
F[B-]1(F)n2cccc2C(c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc2)=C2C=CC=[N+]21,CN(C)C=O,502.0
F[B-]1(F)n2cccc2C(c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc2)=C2C=CC=[N+]21,Cc1ccccc1,505.0
F[B-]1(F)n2cccc2C(c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc2)=C2C=CC=[N+]21,ClCCl,502.0
F[B-]1(F)n2cccc2C(c2ccccc2)=C2C=CC(c3ccc(OC4=[N+]5C(=C(c6ccccc6)c6cc(Br)c(Br)n6[B-]5(F)F)C=C4Br)cc3)=[N+]21,ClC(Cl)Cl,562.0
F[B-]1(F)n2cccc2C(c2ccccc2)=C2C=CC(c3cccc(OC4=[N+]5C(=C(c6ccccc6)c6cc(Br)c(-c7ccc[nH]7)n6[B-]5(F)F)C=C4Br)c3)=[N+]21,ClC(Cl)Cl,627.0
F[B-]1(F)n2cccc2C(c2ccccc2)=C2C=CC(c3cccc(OC4=[N+]5C(=C(c6ccccc6)c6cc(Br)c(Br)n6[B-]5(F)F)C=C4Br)c3)=[N+]21,ClC(Cl)Cl,556.0
F[B-]1(F)n2cccc2C(c2ccccc2)=C2C=c3c([nH]c4ccccc34)=[N+]21,ClCCl,546.0
F[B-]1(F)n2cccc2C(c2cccnc2)=C2C=CC(N3CCOCC3)=[N+]21,ClCCl,487.0
F[B-]1(F)n2cccc2C(c2cccs2)=C2C=CC(N3CCOCC3)=[N+]21,ClCCl,496.0
F[B-]1(F)n2cccc2C2=[N+]1c1cccc3cccc(c13)N2,CC#N,333.0
F[B-]1(F)n2cccc2C2=[N+]1c1cccc3cccc(c13)N2,CO,335.0
F[B-]1(F)n2cccc2C2=[N+]1c1cccc3cccc(c13)N2,CS(C)=O,338.0
F[B-]1(F)n2cccc2C2=[N+]1c1cccc3cccc(c13)N2,Cc1ccccc1,341.0
F[B-]1(F)n2cccc2C=C2c3ccccc3C(c3ccc[nH]3)=[N+]21,C1CCOC1,571.0
F[B-]1(F)n2cccc2C=C2c3ccccc3C(c3ccc[nH]3)=[N+]21,CC#N,561.0
F[B-]1(F)n2cccc2C=C2c3ccccc3C(c3ccc[nH]3)=[N+]21,CCCCCC,574.0
F[B-]1(F)n2cccc2C=C2c3ccccc3C(c3ccc[nH]3)=[N+]21,CO,565.0
F[B-]1(F)n2cccc2C=C2c3ccccc3C(c3ccc[nH]3)=[N+]21,Cc1ccccc1,577.0
F[B-]1(F)n2cccc2C=C2c3ccccc3C(c3ccc[nH]3)=[N+]21,ClCCl,570.0
F[B-]1(F)n2ccnc2-c2cccc[n+]21,C1CCCCC1,298.0
F[B-]1(F)n2ccnc2-c2cccc[n+]21,C1CCOC1,298.0
F[B-]1(F)n2ccnc2-c2cccc[n+]21,C1COCCO1,297.0
F[B-]1(F)n2ccnc2-c2cccc[n+]21,CC#N,295.0
F[B-]1(F)n2ccnc2-c2cccc[n+]21,CCCCCC,297.0
F[B-]1(F)n2ccnc2-c2cccc[n+]21,CO,293.0
F[B-]1(F)n2ccnc2-c2cccc[n+]21,ClC(Cl)Cl,300.0
F[B-]12OC(c3ccccc3)=Nc3cccc([n+]31)N=C(c1ccccc1)O2,ClCCl,394.0
F[B-]12Oc3ccccc3-c3c4[n+]5c(c([n+]31)-c1ccccc1O2)-c1ccccc1O[B-]5(F)Oc1ccccc1-4,ClCCl,553.0
F[Si-](F)(c1ccccc1)(c1ccccc1)c1c2ccccc2cc2ccccc12,C1CCOC1,391.0
F[Si-](F)(c1ccccc1)(c1ccccc1)c1cc2ccccc2c2ccccc12,C1CCOC1,303.0
F[Si-](F)(c1ccccc1)(c1ccccc1)c1cccc2ccccc12,C1CCOC1,286.0
F[Si](c1ccccc1)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,C1CCOC1,397.0
F[Si](c1ccccc1)(c1ccccc1)c1c2ccccc2cc2ccccc12,C1CCOC1,393.0
F[Si](c1ccccc1)(c1ccccc1)c1c2ccccc2cc2ccccc12,ClC(Cl)Cl,394.0
F[Si](c1ccccc1)(c1ccccc1)c1cc2ccccc2c2ccccc12,C1CCOC1,302.0
F[Si](c1ccccc1)(c1ccccc1)c1cccc2ccccc12,C1CCOC1,286.0
Fc1c(-c2nnc(-c3ccccc3)o2)c(-n2c3ccccc3c3ccccc32)c(F)c(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21,Cc1ccccc1,361.0
Fc1c(-n2c3ccccc3c3ccccc32)c(-c2nnc(-c3ccccc3)o2)c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21,Cc1ccccc1,331.0
Fc1c(-n2c3ccccc3c3ccccc32)c(F)c(-n2c3ccccc3c3ccccc32)c(-c2nnc(-c3ccccc3)o2)c1-n1c2ccccc2c2ccccc21,Cc1ccccc1,345.0
Fc1c(F)c(-n2c3ccccc3c3ccccc32)c(F)c(F)c1-c1nnc(-c2ccccc2)o1,Cc1ccccc1,344.0
Fc1c(F)c(-n2c3ccccc3c3ccccc32)c(F)c(F)c1/C=C/C(=C(c1ccccc1)c1ccccc1)c1ccccc1,Cc1ccccc1,360.0
Fc1c(F)c(F)c(-c2cc3cc4cc(-c5c(F)c(F)c(F)c(F)c5F)oc4cc3o2)c(F)c1F,ClCCl,354.0
Fc1c(F)c(F)c(-c2cc3n(c2)[B-](F)(F)[N+]2=CC=CC2=C3c2ccccc2)c(F)c1F,ClCCl,519.0
Fc1c(F)c(F)c(C2=CC3=C(c4ccccc4)c4cc(-c5c(F)c(F)c(F)c(F)c5F)cn4[B-](F)(F)[N+]3=C2)c(F)c1F,ClCCl,546.0
Fc1c(F)c(F)c(C2=CC3=C(c4ccccc4)c4cccn4[B-](F)(F)[N+]3=C2)c(F)c1F,ClCCl,519.0
Fc1c(F)c(F)c([B-]2(c3c(F)c(F)c(F)c(F)c3F)Oc3c(ccc4c5c(ccc34)C=[N+](c3ccccc3)[B-](c3c(F)c(F)c(F)c(F)c3F)(c3c(F)c(F)c(F)c(F)c3F)O5)C=[N+]2c2ccccc2)c(F)c1F,C1CCOC1,522.0
Fc1c(F)c(F)c([B-]2(c3c(F)c(F)c(F)c(F)c3F)Oc3c(ccc4c5c(ccc34)C=[N+](c3ccccc3)[B-](c3c(F)c(F)c(F)c(F)c3F)(c3c(F)c(F)c(F)c(F)c3F)O5)C=[N+]2c2ccccc2)c(F)c1F,CC#N,515.0
Fc1c(F)c(F)c([B-]2(c3c(F)c(F)c(F)c(F)c3F)Oc3c(ccc4c5c(ccc34)C=[N+](c3ccccc3)[B-](c3c(F)c(F)c(F)c(F)c3F)(c3c(F)c(F)c(F)c(F)c3F)O5)C=[N+]2c2ccccc2)c(F)c1F,CC(C)=O,515.0
Fc1c(F)c(F)c([B-]2(c3c(F)c(F)c(F)c(F)c3F)Oc3c(ccc4c5c(ccc34)C=[N+](c3ccccc3)[B-](c3c(F)c(F)c(F)c(F)c3F)(c3c(F)c(F)c(F)c(F)c3F)O5)C=[N+]2c2ccccc2)c(F)c1F,Cc1ccccc1,531.0
Fc1c(F)c(F)c([B-]2(c3c(F)c(F)c(F)c(F)c3F)Oc3c(ccc4c5c(ccc34)C=[N+](c3ccccc3)[B-](c3c(F)c(F)c(F)c(F)c3F)(c3c(F)c(F)c(F)c(F)c3F)O5)C=[N+]2c2ccccc2)c(F)c1F,ClCCl,533.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,C1CCOC1,572.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,C1COCCO1,572.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CC#N,570.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CC(=O)N(C)C,574.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CC(=O)OC(C)=O,572.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CC(C)=O,570.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CCC#N,564.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CCO,570.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CCOC(C)=O,570.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CCOCC,568.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CN(C)C=O,574.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CO,568.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,CS(C)=O,574.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,C[N+](=O)[O-],572.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,O=[N+]([O-])c1ccccc1,578.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,c1ccccc1,574.0
Fc1c(F)c(F)c2c(c1F)C1=Nc3c4c(F)c(F)c(F)c(F)c4c4n3[B-]3(Cl)n5c(c6c(F)c(F)c(F)c(F)c6c5=N4)=NC2=[N+]13,c1ccncc1,576.0
Fc1c(F)c(F)c2nc3c(cc2c1F)c(-c1ccccc1)nn3-c1ccccc1,Cc1ccccc1,415.0
Fc1c(F)c(F)c2nc3onc(-c4ccccc4)c3cc2c1F,CCO,342.0
Fc1cc(-c2ccc(-c3nc4ccccc4[nH]3)cc2)ccc1-c1ccc(-c2nc3ccccc3[nH]2)cc1,CN(C)C=O,343.0
Fc1cc(F)c2cc3cccc[n+]3cc2c1,O,407.0
Fc1cc([N+]2=Cc3cccn3[B-]2(c2ccccc2)c2ccccc2)cc(F)c1F,C1CCOC1,389.93710691823895
Fc1cc2c(c3ccccc13)-c1ccc3c4cccc5cccc(c6ccc-2c1c63)c54,ClCCl,503.0
Fc1ccc(-c2c3ccccc3nc3cc4ccccc4cc23)cc1,ClCCl,400.0
Fc1ccc(-c2cc3c4c(c2)CCc2cc(-c5ccc(F)cc5)cc(c2-4)CC3)cc1,ClC(Cl)Cl,323.560033
Fc1ccc(-c2cc3cc(-c4nnc(-c5ccccc5)o4)ccn3n2)cc1,C1CCCCC1,383.0
Fc1ccc(-c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)c(F)c1,ClCCl,287.0
Fc1ccc(-c2ccc(-c3nc4c5ccccc5c5ccccc5c4n3-c3ccccc3)c3nsnc23)cc1,Cc1ccccc1,416.0
Fc1ccc(-c2cccc3cnc(-c4ccccc4)n23)cc1,ClCCl,336.0
Fc1ccc(-c2cccc3ncc(-c4ccccc4)n23)cc1,ClCCl,336.0
Fc1ccc(-c2cnn(-c3ccc(Cl)cc3)n2)cc1,CO,279.0
Fc1ccc(-c2cnn(-c3ccc(F)cc3)n2)cc1,CO,277.0
Fc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClC(Cl)Cl,322.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,C1CCCCC1,328.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,C1CCOC1,328.5
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,C1COCCO1,328.5
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CC#N,319.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CC(C)(C)O,329.5
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CC(C)O,328.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CCO,325.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CCOC(C)=O,319.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CN(C)C=O,326.5
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CNC=O,325.5
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CO,322.5
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,CS(C)=O,329.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,Cc1ccc(C)cc1,332.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,Cc1ccccc1,333.5
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,ClC(Cl)Cl,329.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,ClCCl,326.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,O,322.0
Fc1ccc(-c2nc3n(c2-c2ccncc2)CCS3)cc1,OCCO,330.0
Fc1ccc(-c2nnc(N=Nc3ccc(-c4cccs4)s3)s2)cc1,CS(C)=O,515.0
Fc1ccc(-c2nnc3ccccn23)cc1,ClCCl,281.0
Fc1ccc(-c2oc3cccc4[n+]3c2-c2ccccc2-4)cc1,ClCCl,372.0
Fc1ccc(-n2ncc(-c3ccc(Cl)cc3)n2)cc1,CO,281.0
Fc1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,332.0
Fc1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3o2)cc1,CC#N,363.0
Fc1ccc(C#Cc2c(C#Cc3ccc(F)cc3)c(C#Cc3ccc(F)cc3)c(C#Cc3ccc(F)cc3)c(C#Cc3ccc(F)cc3)c2C#Cc2ccc(F)cc2)cc1,ClCCl,368.0
Fc1ccc(C#Cc2cc(C#Cc3ccc(F)cc3)c(C#Cc3ccc(F)cc3)c(C#Cc3ccc(F)cc3)c2C#Cc2ccc(F)cc2)cc1,ClCCl,371.0
Fc1ccc(C#Cc2nc(C#Cc3ccc(F)cc3)c(C#Cc3ccc(F)cc3)c(C#Cc3ccc(F)cc3)c2C#Cc2ccc(F)cc2)cc1,ClCCl,407.0
Fc1ccc(C2=C(c3ccc(F)cc3)C3=Cc4ccccc4NB3OB3Nc4ccccc4C=C32)cc1,ClCCl,413.0
Fc1ccc(C2=C(c3ccc(F)cc3)[Si](c3ccccc3)(c3ccccc3)c3ccccc32)cc1,C1CCOC1,330.0
Fc1ccc(C2=C(c3ccc(F)cc3)c3cccc4c3c(cc3nc5ccccc5nc34)O2)cc1,ClCCl,490.0
Fc1ccc(C2=C(c3ccc(F)cc3)c3ccccc3B3Nc4ccccc4C=C32)cc1,ClCCl,383.0
Fc1ccc(C2=Cc3c(-c4ccc(F)cc4)cc[n+]4cccc(c34)O2)cc1,ClCCl,390.0
Fc1ccc(C2=NC(c3ccccc3)C(N(c3ccccc3)c3ccccc3)S2)cc1,ClC(Cl)Cl,363.0
Fc1ccc(C2=[N+]3C(=Nc4c5ccccc5c(-c5ccc(F)cc5)n4[B-]3(F)F)c3ccccc32)cc1,ClCCl,713.0
Fc1ccc(C=Cc2ccc3c4c(ccc3c2)OC(c2ccccc2)(c2ccccc2)C4=C=C(c2ccccc2)c2ccccc2)cc1,C1CCOC1,460.0
Fc1ccc(N(c2ccc(F)cc2)c2ccc3c4cccc5c(N(c6ccc(F)cc6)c6ccc(F)cc6)ccc(c6cccc2c63)c54)cc1,C1CCCCC1,493.0
Fc1ccc(N(c2ccc(F)cc2)c2ccc3c4cccc5c(N(c6ccc(F)cc6)c6ccc(F)cc6)ccc(c6cccc2c63)c54)cc1,C1CCOC1,488.0
Fc1ccc(N(c2ccc(F)cc2)c2ccc3c4cccc5c(N(c6ccc(F)cc6)c6ccc(F)cc6)ccc(c6cccc2c63)c54)cc1,CC#N,484.0
Fc1ccc(N(c2ccc(F)cc2)c2ccc3c4cccc5c(N(c6ccc(F)cc6)c6ccc(F)cc6)ccc(c6cccc2c63)c54)cc1,Cc1ccccc1,493.0
Fc1ccc(N(c2ccc(F)cc2)c2ccc3c4cccc5c(N(c6ccc(F)cc6)c6ccc(F)cc6)ccc(c6cccc2c63)c54)cc1,ClCCl,461.0
Fc1ccc(N(c2ccccc2)c2ccc3ccc4c(N(c5ccccc5)c5ccc(F)cc5)ccc5ccc2c3c54)cc1,ClCCl,423.0
Fc1ccc(Nc2ccc3ccccc3n2)cc1,CCO,350.0
Fc1ccc(Nc2ccc3ccccc3n2)cc1,CCOC(C)=O,349.0
Fc1ccc(Nc2ccc3ccccc3n2)cc1,Cc1ccccc1,348.0
Fc1ccc2c(c1)C(c1ccccc1)=C(c1ccccc1)C1=Cc3ccccc3NB12,ClCCl,379.0
Fc1ccc2c(c1)N(Cc1ccccc1)B1OB3C(=Cc4ccc(F)cc4N3Cc3ccccc3)C(c3ccccc3)=C(c3ccccc3)C1=C2,ClCCl,412.0
Fc1ccc2c(c1)c1cccc3cnc2n31,CO,430.0
Fc1ccc2c(c1)c1ccccc1n1c3ccccc3nc21,CC#N,305.0
Fc1ccc2cc3cccc[n+]3cc2c1,O,400.0
Fc1ccc2nc(-c3ccccc3OCc3ccccc3)sc2c1,CCO,322.0
Fc1ccc2sc3nc(-c4ccccc4)sc3c2c1,CS(C)=O,345.0
Fc1cccc(-c2[o+]c3c(-c4cccc(F)c4)c(-c4cccc(F)c4)c4cccc5ccc(c2-c2cccc(F)c2)c3c54)c1,ClCCl,485.0
Fc1cccc(C2=C(c3cccc(F)c3)c3ccc4c5c(ccc(c35)O2)OC(c2cccc(F)c2)=C4c2cccc(F)c2)c1,ClCCl,497.0
Fc1cccc(F)c1-c1cc2n(c1)[B-](F)(F)[N+]1=CC=CC1=C2c1ccccc1,ClCCl,527.0
Fc1cccc(F)c1C1=CC2=C(c3ccccc3)c3cc(-c4c(F)cccc4F)cn3[B-](F)(F)[N+]2=C1,ClCCl,559.0
Fc1cccc(F)c1[B-]1(c2c(F)cccc2F)Oc2c(ccc3c4c(ccc23)C=[N+](c2ccccc2)[B-](c2c(F)cccc2F)(c2c(F)cccc2F)O4)C=[N+]1c1ccccc1,Cc1ccccc1,538.0
Fc1cccc(F)c1[B-]1(c2c(F)cccc2F)Oc2c(ccc3c4c(ccc23)C=[N+](c2ccccc2)[B-](c2c(F)cccc2F)(c2c(F)cccc2F)O4)C=[N+]1c1ccccc1,ClCCl,534.0
Fc1cccc2c1C=C1B(c3ccccc3C(c3ccccc3)=C1c1ccccc1)N2Cc1ccccc1,ClCCl,392.0
Fc1ccccc1,CN(C)C=O,348.0
Fc1ccccc1-c1c2cc(Cl)ccc2nc2cc3ccccc3cc12,ClCCl,402.0
Fc1ccccc1-c1nc2c(c3c1-c1ccccc1CC3)-c1ccccc1CC2,ClC(Cl)Cl,323.0
Fc1ccccc1-c1nc2sc3ccccc3c2s1,CS(C)=O,344.0
Fc1ccccc1C1=C(c2ccccc2F)c2ccc3c4c(ccc(c24)O1)OC(c1ccccc1F)=C3c1ccccc1F,ClCCl,463.0
Fc1ccccc1N1c2c(sc3ccccc23)Sc2sc3ccccc3c21,ClCCl,353.0
Fc1nc(F)c(F)c(/C=C2/C(c3c(F)c(F)nc(F)c3F)=Cc3ccccc32)c1F,CC#N,335.0
Fc1nc(F)c(F)c(C#Cc2cc3c(cc2C#Cc2c(F)c(F)nc(F)c2F)OC2(CCCCC2)O3)c1F,CC#N,360.0
Fc1nc(F)c(F)c(C#Cc2ccccc2C#Cc2c(F)c(F)nc(F)c2F)c1F,CC#N,300.0
Fc1nc(F)c(F)c(C#Cc2nccnc2C#Cc2c(F)c(F)nc(F)c2F)c1F,CC#N,305.0
II,CCCCCCC,522.5688073
II,ClC(Cl)(Cl)Cl,516.4525994
I[I-]I,O,351.7697027
Ic1ccc(-c2c3ccc(=[N+]4CCCCC4)cc-3oc3cc(N4CCCCC4)ccc23)cc1,CCO,568.0
Ic1ccc(-c2c3ccc(=[N+]4CCCCC4)cc-3oc3cc(N4CCCCC4)ccc23)cc1,ClCCl,570.0
Ic1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,349.0
Ic1ccc(C2=C3C=CC4=[N+]3[B-]3(Oc5ccccc54)Oc4ccccc4-c4ccc2n43)cc1,ClC(Cl)Cl,630.0
N#C/C(=C(/C#N)c1ccc(-c2ccncc2)cc1)c1ccc(-c2ccncc2)cc1,ClCCl,343.0
N#C/C(=C/Nc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,CC#N,372.0
N#C/C(=C/Nc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,CCO,373.0
N#C/C(=C/Nc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,CN(C)C=O,376.0
N#C/C(=C/Nc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,Cc1ccccc1,377.0
N#C/C(=C/Nc1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,ClCCl,375.0
N#C/C(=C/c1cc2sc(-c3ccc(-c4ccc(N5c6ccccc6C6C7CCC(C7)C65)cc4)s3)cc2s1)C(=O)O,ClCCl,505.0
N#C/C(=C/c1cc2sc(-c3ccc(N(c4ccccc4)c4ccc(-c5cc6sc(/C=C(\C#N)C(=O)O)cc6s5)cc4)cc3)cc2s1)C(=O)O,CCO,454.0
N#C/C(=C/c1cc2sc(-c3sc(-c4ccc(N5c6ccccc6C6C7CCC(C7)C65)cc4)c4c3OCCO4)cc2s1)C(=O)O,ClCCl,535.0
N#C/C(=C/c1ccc(-c2ccc(-c3ccc(/C=C(/C#N)C(=O)O)s3)c3nsnc23)s1)C(=O)O,C1CCOC1,455.0
N#C/C(=C/c1ccc(-c2ccc(-c3ccc(/C=C(\C#N)C(=O)O)s3)s2)s1)C(=O)O,CS(C)=O,480.0
N#C/C(=C/c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,C1CCOC1,448.0
N#C/C(=C/c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,ClC(Cl)Cl,455.0
N#C/C(=C/c1ccc(-c2ccc(-c3ccc(N4c5ccccc5C5C6CCC(C6)C54)cc3)s2)cc1)C(=O)O,ClCCl,467.0
N#C/C(=C/c1ccc(-c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,ClC(Cl)Cl,517.0
N#C/C(=C/c1ccc(-c2ccc(-c3sc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c4c3OCCO4)s2)s1)C(=O)O,ClCCl,590.0
N#C/C(=C/c1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,C1CCOC1,425.0
N#C/C(=C/c1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,CN(C)C=O,436.0
N#C/C(=C/c1ccc(-c2ccc(N(c3ccc(-c4cccs4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,CN(C)C=O,421.0
N#C/C(=C/c1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)s1)C(=O)O,C1CCOC1,411.0
N#C/C(=C/c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClCCl,473.0
N#C/C(=C/c1ccc(-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)s1)C(=O)O,C1CCOC1,371.0
N#C/C(=C/c1ccc(-c2ccc3c(c2)C2CCCC2N3c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClC(Cl)Cl,519.0
N#C/C(=C/c1ccc(-c2ccc3oc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4c3c2)s1)C(=O)O,C1CCOC1,406.0
N#C/C(=C/c1ccc(-c2ccc3sc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4c3c2)o1)C(=O)O,C1CCOC1,407.0
N#C/C(=C/c1ccc(-c2ccc3sc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4c3c2)s1)C(=O)O,C1CCOC1,414.0
N#C/C(=C/c1ccc(-c2nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)n2)cc1)C(=O)O,CN(C)C=O,459.0
N#C/C(=C/c1ccc(-n2c3ccccc3c3ccccc32)cc1)C(=O)O,ClCCl,401.0
N#C/C(=C/c1ccc(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(N(c3ccccc3)c3ccccc3)=C3/C=CC(=N3)/C=4c3ccccc3)/C(c3ccccc3)=C3/C=CC2=N3)cc1)C(=O)O,ClCCl,432.0
N#C/C(=C/c1ccc(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(N3c5ccccc5C=Cc5ccccc53)=C3/C=CC(=N3)/C=4c3ccccc3)/C(c3ccccc3)=C3/C=CC2=N3)cc1)C(=O)O,ClCCl,422.0
N#C/C(=C/c1ccc(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(N3c5ccccc5CCc5ccccc53)=C3/C=CC(=N3)/C=4c3ccccc3)/C(c3ccccc3)=C3/C=CC2=N3)cc1)C(=O)O,ClCCl,425.0
N#C/C(=C/c1ccc(/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)C(=O)O,C1CCOC1,433.0
N#C/C(=C/c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1-c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,C1CCOC1,448.0
N#C/C(=C/c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1-c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,CCO,448.0
N#C/C(=C/c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1-c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,CN(C)C=O,448.0
N#C/C(=C/c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1-c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,448.0
N#C/C(=C/c1ccc(/C=C/c2ccc(N3c4ccccc4C=Cc4ccccc43)cc2)s1)C(=O)O,ClCCl,498.0
N#C/C(=C/c1ccc(/C=C/c2ccc(N3c4ccccc4CCc4ccccc43)cc2)s1)C(=O)O,ClCCl,467.0
N#C/C(=C/c1ccc(/C=N/N(c2ccccc2)c2ccccc2)s1)C(=O)O,C1CCOC1,465.0
N#C/C(=C/c1ccc(C#C/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(N(c3ccccc3)c3ccccc3)=C3/C=CC(=N3)/C=4c3ccccc3)/C(c3ccccc3)=C3/C=CC2=N3)cc1)C(=O)O,C1CCOC1,644.0
N#C/C(=C/c1ccc(N(c2ccc(N3CCc4ccccc43)cc2)c2ccc(N3CCc4ccccc43)cc2)cc1)C(=O)O,ClC(Cl)Cl,449.0
N#C/C(=C/c1ccc(N(c2ccc(N3c4ccccc4Sc4ccccc43)cc2)c2ccc(N3c4ccccc4Sc4ccccc43)cc2)cc1)C(=O)O,ClCCl,433.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)cc1)C(=O)O,CCO,397.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1)C(=O)O,CO,416.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1)C(=O)O,ClC(Cl)Cl,426.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccc(/C=C(\C#N)c3ccc(/C=C(\C#N)C(=O)O)s3)cc2)cc1)c1ccc(/C=C(\C#N)C(=O)O)s1,CN(C)C=O,484.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,CCO,395.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,CO,407.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClC(Cl)Cl,448.0
N#C/C(=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClCCl,438.0
N#C/C(=C/c1ccc2c(c1)C1(c3cc(/C=C(\C#N)C(=O)O)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc31)c1cc(N(c3ccccc3)c3ccccc3)ccc1-2)C(=O)O,C1CCOC1,427.0
N#C/C(=C/c1ccc2c(c1)C1(c3cc(/C=C(\C#N)C(=O)O)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc31)c1cc(N(c3ccccc3)c3ccccc3)ccc1-2)C(=O)O,CC#N,392.0
N#C/C(=C/c1ccc2c(c1)C1(c3cc(/C=C(\C#N)C(=O)O)ccc3-c3ccc(N(c4ccccc4)c4ccccc4)cc31)c1cc(N(c3ccccc3)c3ccccc3)ccc1-2)C(=O)O,Cc1ccccc1,446.0
N#C/C(=C/c1ccc2c(c1)C1CCCC1N2c1ccc(C=C(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClC(Cl)Cl,463.0
N#C/C(=C/c1ccc2c(c1)CC(c1ccc(N(c3ccccc3)c3cccc4ccccc34)cc1)=C2)C(=O)O,C1CCOC1,437.0
N#C/C(=C/c1ccc2c(c1)CC(c1ccc(N(c3ccccc3)c3ccccc3)cc1)=C2)C(=O)O,C1CCOC1,426.0
N#C/C(=C/c1ccc2c(c1)Sc1ccccc1N2c1ccccc1)C(=O)O,CC#N,417.0
N#C/C(=C/c1ccc2c(c1)c1ccccc1n2-c1ccccc1)C(=O)O,CC#N,395.0
N#C/C(=C/c1ccc2cc(-c3ccccc3)c3ccc4c(-c5ccccc5)cc1c2n34)C(=O)O,CN(C)C=O,446.0
N#C/C(=C/c1ccc2ccc3cccc4ccc1c2c34)c1ccc(/C=C2/SC(=S)N(CC(=O)O)C2=O)s1,CN(C)C=O,468.0
N#C/C(=C/c1ccc2nc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc2c1)C(=O)O,ClC(Cl)Cl,464.0
N#C/C(=C/c1ccc2nc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)sc2c1)C(=O)O,ClC(Cl)Cl,411.0
N#C/C(=C/c1cn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12)C(=O)O,CCO,375.0
N#C/C(=C/c1sc(-c2ccc(N(c3ccc(-c4ccc5c(c4)[nH]c4ccccc45)cc3)c3ccc(-c4sc(/C=C(/C#N)C(=O)O)c5c4OCCO5)cc3)cc2)c2c1OCCO2)C(=O)O,CCO,516.0
N#C/C(=C/c1sc(-c2ccc(N(c3ccccc3)c3ccc(-c4sc(/C=C(/C#N)C(=O)O)c5c4OCCO5)cc3)cc2)c2c1OCCO2)C(=O)O,CCO,493.0
N#C/C(=C/c1sc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2c1OCCO2)C(=O)O,CCO,482.0
N#C/C(=C/c1sc(/C=C(\C#N)C(=O)O)c(-c2cccc(N(c3ccccc3)c3ccccc3)c2)c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClC(Cl)Cl,307.0
N#C/C(=C/c1sc(/C=N/N(c2ccccc2)c2ccccc2)c2c1OCCO2)C(=O)O,C1CCOC1,490.0
N#C/C(=C\C1=C2OC(c3ccccc3)=CC(c3ccccc3)=C2CCC1)C(=O)O,ClCCl,549.0
N#C/C(=C\C1=C2SC(c3ccccc3)=CC(c3ccccc3)=C2CCC1)C(=O)O,ClCCl,557.0
N#C/C(=C\C1=CC2=N/C1=C(/c1ccccc1)c1ccc3n1[Zn]n1/c(cc/c1=C/2c1ccccc1)=C(/c1ccccc1)C1=N/C(=C\3c2ccccc2)C=C1)C(=O)O,ClCCl,620.0
N#C/C(=C\C=C\C1=C2OC(c3ccccc3)=CC(c3ccccc3)=C2CCC1)C(=O)O,ClCCl,604.0
N#C/C(=C\C=C\C1=C2SC(c3ccccc3)=CC(c3ccccc3)=C2CCC1)C(=O)O,ClCCl,596.0
N#C/C(=C\C=C\c1cc2sc(C=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)cc2s1)C(=O)O,ClCCl,583.0
N#C/C(=C\C=C\c1ccccc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,420.0
N#C/C(=C\C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1,C1CCOC1,373.0
N#C/C(=C\C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1,C1COCCO1,371.0
N#C/C(=C\C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1,CC#N,374.0
N#C/C(=C\C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1,CCCCCCC,366.0
N#C/C(=C\C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1,CN(C)C=O,376.0
N#C/C(=C\C=C\c1ccccc1)c1ccc([N+](=O)[O-])cc1,CO,375.0
N#C/C(=C\C=C\c1ccccc1)c1ccccc1,C1CCOC1,343.0
N#C/C(=C\C=C\c1ccccc1)c1ccccc1,C1COCCO1,343.0
N#C/C(=C\C=C\c1ccccc1)c1ccccc1,CC#N,343.0
N#C/C(=C\C=C\c1ccccc1)c1ccccc1,CCCCCCC,341.0
N#C/C(=C\C=C\c1ccccc1)c1ccccc1,CN(C)C=O,349.0
N#C/C(=C\C=C\c1ccccc1)c1ccccc1,CO,343.0
N#C/C(=C\[C@@H]1COc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc(COCCCCCCCCOCc3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3O[C@H](/C=C(\C#N)C(=O)O)CO4)c2O1)C(=O)O,ClC(Cl)Cl,488.0
N#C/C(=C\[C@@H]1COc2c(COCCCCCCCCOCc3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OC[C@@H](/C=C(\C#N)C(=O)O)O4)sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2O1)C(=O)O,ClC(Cl)Cl,501.0
N#C/C(=C\c1c(F)cc(/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1F)C(=O)O,C1CCOC1,421.0
N#C/C(=C\c1cc(-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)on1)C(=O)O,CN(C)C=O,416.0
N#C/C(=C\c1cc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,C1CCOC1,462.0
N#C/C(=C\c1cc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)s2)c(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)s2)s1)C(=O)O,ClCCl,503.0
N#C/C(=C\c1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,ClCCl,490.0
N#C/C(=C\c1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(-c2ccc(N(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)cc2)s1)C(=O)O,ClC(Cl)Cl,493.0
N#C/C(=C\c1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(-c2sc(-c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClCCl,490.0
N#C/C(=C\c1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(-c2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClCCl,494.0
N#C/C(=C\c1cc(-c2cccs2)c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1-c1cccs1)C(=O)O,ClCCl,425.0
N#C/C(=C\c1cc(Br)c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1Br)C(=O)O,ClCCl,441.0
N#C/C(=C\c1cc(C#N)c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1C#N)C(=O)O,ClCCl,500.0
N#C/C(=C\c1cc(Cl)c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1Cl)C(=O)O,ClCCl,444.0
N#C/C(=C\c1cc2sc(-c3cc4sc(-c5ccc(N(c6ccc7c(c6)OCCO7)c6ccc7c(c6)OCCO7)cc5)cc4s3)cc2s1)C(=O)O,ClCCl,510.0
N#C/C(=C\c1cc2sc(-c3cc4sc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4s3)cc2s1)C(=O)O,ClCCl,497.0
N#C/C(=C\c1cc2sc(-c3cc4sc5cc(-c6ccc(N(c7ccc8c(c7)OCCO8)c7ccc8c(c7)OCCO8)cc6)sc5c4s3)cc2s1)C(=O)O,ClCCl,495.0
N#C/C(=C\c1cc2sc(-c3ccc(-c4ccc(N(c5ccc6c(c5)OCCO6)c5ccc6c(c5)OCCO6)cc4)s3)cc2s1)C(=O)O,ClCCl,499.0
N#C/C(=C\c1cc2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2s1)C(=O)O,CN(C)C=O,467.0
N#C/C(=C\c1cc2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2s1)C(=O)O,ClCCl,495.0
N#C/C(=C\c1cc2sc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2s1)C(=O)O,CN(C)C=O,503.0
N#C/C(=C\c1cc2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2s1)C(=O)O,ClC(Cl)Cl,493.0
N#C/C(=C\c1cc2sc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCCO4)cc2s1)C(=O)O,ClCCl,501.0
N#C/C(=C\c1cc2sc(C=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)cc2s1)C(=O)O,ClCCl,551.0
N#C/C(=C\c1cc2sc3cc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)sc3c2s1)C(=O)O,ClCCl,472.0
N#C/C(=C\c1ccc(-c2c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)s1)C(=O)O,C1CCOC1,522.0
N#C/C(=C\c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)s1)C(=O)O,C1CCOC1,465.0
N#C/C(=C\c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)sc2-c2ccc(/C=C(\C#N)C(=O)O)cc2)cc1)C(=O)O,C1CCOC1,462.0
N#C/C(=C\c1ccc(-c2cc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)sc2-c2ccc(/C=C(\C#N)C(=O)O)s2)s1)C(=O)O,C1CCOC1,478.0
N#C/C(=C\c1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc2-c2ccc(/C=C(\C#N)C(=O)O)s2)s1)C(=O)O,C1CCOC1,472.0
N#C/C(=C\c1ccc(-c2cc3c4ccccc4n4c5ccccc5c(c2)c34)cc1)C(=O)O,ClCCl,376.0
N#C/C(=C\c1ccc(-c2cc3c4ccccc4n4c5ccccc5c(c2)c34)s1)C(=O)O,ClCCl,380.5
N#C/C(=C\c1ccc(-c2cc3cc(-c4ccc5c(c4)N(c4ccccc4)C4CCCC54)ccc3oc2=O)s1)C(=O)O,CN(C)C=O,405.0
N#C/C(=C\c1ccc(-c2cc3cc(N4c5ccccc5C5CCCC54)ccc3oc2=O)s1)C(=O)O,CN(C)C=O,394.0
N#C/C(=C\c1ccc(-c2cc3sc(-c4ccc(N(c5ccc6c(c5)OCCO6)S5=CC6=C(C=C5)OCCO6)cc4)cc3s2)cc1)C(=O)O,ClCCl,474.0
N#C/C(=C\c1ccc(-c2cc3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3s2)cc1)C(=O)O,ClCCl,460.0
N#C/C(=C\c1ccc(-c2cc3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3s2)s1)C(=O)O,ClCCl,503.0
N#C/C(=C\c1ccc(-c2cc3sc(-c4ccc5c(c4)N(c4ccccc4)C4C6CCC(C6)C54)cc3s2)s1)C(=O)O,ClCCl,526.0
N#C/C(=C\c1ccc(-c2cc3sc4cc(-c5ccc(N(c6ccc7c(c6)OCCO7)c6ccc7c(c6)OCCO7)cc5)sc4c3s2)s1)C(=O)O,ClCCl,512.0
N#C/C(=C\c1ccc(-c2cc3sc4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)sc4c3s2)cc1)C(=O)O,ClCCl,470.0
N#C/C(=C\c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)c(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)s2)s1)C(=O)O,C1CCOC1,462.0
N#C/C(=C\c1ccc(-c2ccc(-c3cc4c5c(c3)CCCN5CCC4)c3nsnc23)s1)C(=O)O,CCO,572.0
N#C/C(=C\c1ccc(-c2ccc(-c3cc4c5ccccc5n5c6ccccc6c(c3)c45)cc2)cc1)C(=O)O,ClCCl,380.5
N#C/C(=C\c1ccc(-c2ccc(-c3cc4c5ccccc5n5c6ccccc6c(c3)c45)cc2)s1)C(=O)O,ClCCl,376.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-c4cc5c6c(c4)CCCN6CCC5)cc3)s2)s1)C(=O)O,CCO,457.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-c4cc5ccc6c7ccccc7[nH]c6c5s4)s3)s2)s1)C(=O)O,ClC(Cl)Cl,486.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-c4ccc(N(c5ccc6c(c5)OCCO6)c5ccc6c(c5)OCCO6)cc4)s3)s2)cc1)C(=O)O,ClCCl,472.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)s2)s1)C(=O)O,CN(C)C=O,481.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3nsnc23)s1)C(=O)O,C1CCOC1,533.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)cc1)C(=O)O,ClCCl,447.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)N(c4ccccc4)C4C6CCC(C6)C54)s3)s2)s1)C(=O)O,ClCCl,519.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-n4c5ccc(-c6ccc(C=Cc7ccc(N(c8ccccc8)c8ccccc8)cc7)cc6)cc5c5cc(-c6ccc(C=Cc7ccc(N(c8ccccc8)c8ccccc8)cc7)cc6)ccc54)s3)c3nsnc23)s1)C(=O)O,CN(C)C=O,488.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)s3)s2)s1)C(=O)O,ClCCl,467.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(/C=C(\C#N)c4ccc([N+](=O)[O-])cc4)s3)c3c2C(=O)OC3=O)s1)c1ccc([N+](=O)[O-])cc1,C1CCOC1,615.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3nsnc23)s1)C(=O)O,C1CCOC1,546.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(C#Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3nsnc23)s1)C(=O)O,C1CCOC1,515.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(C4=CC=CCC4)c4ccccc4)cc3)s2)s1)C(=O)O,C1CCOC1,473.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccc(/C=C/Cc5cc6ccc5CCCc5ccc(cc5)CCC6)cc4)c4ccc(/C=C/Cc5cc6ccc5CCCc5ccc(cc5)CCC6)cc4)cc3)s2)s1)C(=O)O,C1CCOC1,479.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccc(/C=C/c5ccccc5)cc4)c4ccc(/C=C/c5ccccc5)cc4)cc3)s2)s1)C(=O)O,C1CCOC1,477.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccc(C#Cc5cc6ccc5CCCc5ccc(cc5)CCC6)cc4)c4ccc(C#Cc5cc6ccc5CCCc5ccc(cc5)CCC6)cc4)cc3)s2)s1)C(=O)O,C1CCOC1,446.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccc(C#Cc5ccccc5)cc4)c4ccc(C#Cc5ccccc5)cc4)cc3)s2)s1)C(=O)O,C1CCOC1,445.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)OCCO5)c4ccc5c(c4)OCCO5)cc3)s2)cc1)C(=O)O,ClCCl,471.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)s1)C(=O)O,CN(C)C=O,457.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1)C(=O)O,C1CCOC1,375.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)s1)C(=O)O,C1CCOC1,422.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)s2)cc1)C(=O)O,C1CCOC1,422.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)s2)s1)C(=O)O,C1CCOC1,461.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)s3)s2)s1)C(=O)O,C1CCOC1,480.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3n[se]nc23)s1)C(=O)O,C1CCOC1,503.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)s1)C(=O)O,CN(C)C=O,460.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)s1)C(=O)O,C1CCOC1,491.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)C(=O)O,C1CCOC1,380.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)s1)C(=O)O,C1CCOC1,416.5
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)cc1)C(=O)O,C1CCOC1,427.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)cc1)C(=O)O,ClCCl,440.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,CCO,438.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,CN(C)C=O,467.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,ClC(Cl)Cl,460.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)s2)s1)C(=O)O,C1CCOC1,468.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc(N4c5ccccc5C=Cc5ccccc54)cc3)c3nsnc23)s1)C(=O)O,ClCCl,494.0
N#C/C(=C\c1ccc(-c2ccc(-c3ccc4c(c3)N(c3ccccc3)C3C5CCC(C5)C43)s2)s1)C(=O)O,ClCCl,528.0
N#C/C(=C\c1ccc(-c2ccc(-c3cccs3)s2)s1)C(=O)O,CS(C)=O,439.0
N#C/C(=C\c1ccc(-c2ccc(-c3nnc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)o3)cc2)s1)C(=O)O,CCO,406.0
N#C/C(=C\c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)s1)C(=O)O,ClCCl,416.0
N#C/C(=C\c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)s2)s1)C(=O)O,ClCCl,440.0
N#C/C(=C\c1ccc(-c2ccc(/C3=c4\cc/c5n4[Zn]n4c(ccc4/C(c4ccc(-n6c7ccccc7c7ccccc76)cc4)=C4/C=CC3=N4)/C(c3ccc(-n4c6ccccc6c6ccccc64)cc3)=C3/C=CC(=N3)/C=5c3ccc(-n4c5ccccc5c5ccccc54)cc3)s2)s1)C(=O)O,ClCCl,597.0
N#C/C(=C\c1ccc(-c2ccc(/C3=c4\cc/c5n4[Zn]n4c(ccc4/C(c4ccc(-n6c7ccccc7c7ccccc76)s4)=C4/C=CC(=N4)/C=5c4ccc(-n5c6ccccc6c6ccccc65)s4)/C(c4ccc(-n5c6ccccc6c6ccccc65)s4)=C4/C=CC3=N4)s2)s1)C(=O)O,ClCCl,561.0
N#C/C(=C\c1ccc(-c2ccc(/C=C3/c4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc4-c4cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)sc43)s2)s1)C(=O)O,C1CCOC1,437.0
N#C/C(=C\c1ccc(-c2ccc(C#Cc3ccc(N4c5ccccc5C=Cc5ccccc54)cc3)c3nsnc23)cc1)C(=O)O,ClCCl,455.0
N#C/C(=C\c1ccc(-c2ccc(C#Cc3ccc(N4c5ccccc5C=Cc5ccccc54)cc3)c3nsnc23)s1)C(=O)O,ClCCl,474.0
N#C/C(=C\c1ccc(-c2ccc(C(=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,436.0
N#C/C(=C\c1ccc(-c2ccc(C=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)s2)cc1)C(=O)O,CN(C)C=O,463.0
N#C/C(=C\c1ccc(-c2ccc(C=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)s1)C(=O)O,C1CCOC1,500.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,CN(C)C=O,436.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4ccc(C=O)cc4)cc3)c3ccc(-c4ccc(/C=C(\C#N)c5ccc(C#N)cc5)cc4)cc3)cc2)cc1)c1ccc(C#N)cc1,C1CCOC1,418.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)cc2)s1)C(=O)O,ClC(Cl)Cl,502.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2)s1)C(=O)O,ClCCl,468.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4cccs4)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,CN(C)C=O,421.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4cccs4)cc3)c3ccc(-c4cccs4)cc3)cc2)cc1)C(=O)O,ClC(Cl)Cl,425.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4cccs4)cc3)c3ccc(-c4cccs4)cc3)cc2)s1)C(=O)O,CN(C)C=O,419.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-c4cccs4)cc3)c3ccc(-c4cccs4)cc3)cc2)s1)C(=O)O,ClCCl,470.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)s1)C(=O)O,ClCCl,454.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(/C=C/c4ccccc4)cc3)c3ccc(/C=C/c4ccccc4)cc3)cc2)o1)C(=O)O,ClCCl,454.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(/C=C/c4ccccc4)cc3)c3ccc(/C=C/c4ccccc4)cc3)cc2)s1)C(=O)O,ClCCl,461.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(/C=C/c4ccco4)cc3)c3ccc(/C=C/c4ccco4)cc3)cc2)o1)C(=O)O,ClCCl,471.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc2)s1)C(=O)O,CN(C)C=O,478.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(I)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)s1)C(=O)O,CN(C)C=O,409.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(I)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)s1)C(=O)O,ClCCl,471.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)s1)C(=O)O,C1CCOC1,447.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(N4c5ccccc5Sc5ccccc54)cc3)c3ccc(N4c5ccccc5Sc5ccccc54)cc3)cc2)cc1)C(=O)O,CC#N,385.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccc(N4c5ccccc5Sc5ccccc54)cc3)c3ccc(N4c5ccccc5Sc5ccccc54)cc3)cc2)s1)C(=O)O,CC#N,406.0
N#C/C(=C\c1ccc(-c2ccc(N(c3cccc(-c4cccs4)c3)c3cccc(-c4cccs4)c3)cc2)cc1)C(=O)O,ClC(Cl)Cl,425.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccccc4)cc3)cc2)s1)C(=O)O,ClC(Cl)Cl,458.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)C(=O)O,ClCCl,395.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(F)c1)C(=O)O,ClCCl,420.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2nc(-c3ccccc3)c(-c3ccccc3)nc12)C(=O)O,CN(C)C=O,433.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,431.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)o1)C(=O)O,C1CCOC1,456.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,C1CCOC1,415.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,CO,482.0
N#C/C(=C\c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClC(Cl)Cl,442.0
N#C/C(=C\c1ccc(-c2ccc(N3CCCCC3)s2)s1)C(=O)O,CC#N,452.0
N#C/C(=C\c1ccc(-c2ccc(N3c4ccc(cc4)/C=C\c4ccc(cc4)N(c4ccccc4)c4ccc(cc4)/C=C\c4ccc3cc4)cc2)s1)C(=O)O,ClCCl,492.0
N#C/C(=C\c1ccc(-c2ccc(N3c4ccccc4C=Cc4ccccc43)cc2)s1)C(=O)O,ClCCl,470.0
N#C/C(=C\c1ccc(-c2ccc(N3c4ccccc4CCc4ccccc43)cc2)s1)C(=O)O,ClCCl,422.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)CCN3c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClCCl,361.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)CCc2cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc2N3CCCCCCO)s1)C(=O)O,ClCCl,459.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)CCc2cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc2N3CCCCCCOc2ccc(C(=O)O)cc2)s1)C(=O)O,ClCCl,458.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)Sc2cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc2N3c2ccc(C(=C(c3ccccc3)c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,C1CCOC1,484.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)Sc2ccccc2N3C2CCCCC2)s1)C(=O)O,CN(C)C=O,390.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)Sc2ccccc2N3CCCCCCn2c3ccccc3c3cc(-c4ccc(/C=C(\C#N)C(=O)O)s4)ccc32)s1)C(=O)O,CN(C)C=O,397.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,CCO,406.0
N#C/C(=C\c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)s1)C(=O)O,C1CCOC1,400.0
N#C/C(=C\c1ccc(-c2ccncc2)cc1)c1ccc(-c2ccncc2)cc1,ClCCl,356.0
N#C/C(=C\c1ccc(-c2csc3cc(-c4ccc(N(c5ccc6c(c5)OCCO6)c5ccc6c(c5)OCCO6)cc4)sc23)s1)C(=O)O,ClCCl,512.0
N#C/C(=C\c1ccc(-c2nnc(-c3c4ccccc4cc4ccccc34)o2)s1)C(=O)O,ClC(Cl)Cl,400.0
N#C/C(=C\c1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)o2)cc1)C(=O)O,CCO,375.0
N#C/C(=C\c1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3c2OCCO3)cc1)C(=O)O,CN(C)C=O,420.0
N#C/C(=C\c1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3c2OCCO3)cc1)C(=O)O,ClCCl,477.0
N#C/C(=C\c1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3c2OCCO3)cc1F)C(=O)O,CN(C)C=O,420.0
N#C/C(=C\c1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3c2OCCO3)s1)C(=O)O,C1CCOC1,470.0
N#C/C(=C\c1ccc(-c2sc(-c3ccc(N4c5ccccc5C5C6CCC(C6)C54)cc3)c3c2OCCO3)s1)C(=O)O,ClCCl,535.0
N#C/C(=C\c1ccc(-c2sc(-c3ccc4c(c3)N(c3ccccc3)C3C5CCC(C5)C43)c3c2OCCO3)cc1)C(=O)O,ClCCl,511.0
N#C/C(=C\c1ccc(-c2sc(-c3ccc4c(c3)N(c3ccccc3)C3C5CCC(C5)C43)c3c2OCCO3)s1)C(=O)O,ClCCl,555.0
N#C/C(=C\c1ccc(/C(C#N)=C/c2ccc(N(c3ccccn3)c3ccccn3)cc2)s1)C(=O)O,CN(C)C=O,426.0
N#C/C(=C\c1ccc(/C(C#N)=C/c2ccc(N(c3ccccn3)c3ccccn3)s2)s1)C(=O)O,CN(C)C=O,482.0
N#C/C(=C\c1ccc(/C(C#N)=C/c2ccc3ccc4cccc5ccc2c3c45)s1)C(=O)O,CN(C)C=O,423.0
N#C/C(=C\c1ccc(/C=C/c2c(N(c3ccccc3)c3ccccc3)ccc3ccccc23)cc1)C(=O)O,CCO,404.0
N#C/C(=C\c1ccc(/C=C/c2c(N3CCCC3)ccc3ccccc23)cc1)C(=O)O,CCO,407.0
N#C/C(=C\c1ccc(/C=C/c2cc3ccc2CCc2ccc(c(/C=C/c4ccc(/C=C/c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)c2)CC3)cc1)C(=O)O,C1CCOC1,400.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3cccc4ccccc34)cc2)cc1)C(=O)O,C1CCOC1,434.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2nc(-c3ccccc3)c(-c3ccccc3)nc12)C(=O)O,CN(C)C=O,463.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,C1CCOC1,433.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)S(=O)(=O)O,ClCCl,422.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1F)C(=O)O,C1CCOC1,436.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1-c1c(F)c(F)c(F)c(F)c1F)C(=O)O,ClCCl,493.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1-c1ccc(C#N)cc1)C(=O)O,ClCCl,490.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,CO,497.0
N#C/C(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClCCl,490.0
N#C/C(=C\c1ccc(/C=C/c2ccc3cc(N(c4ccccc4)c4ccccc4)ccc3c2)cc1)C(=O)O,CCO,406.0
N#C/C(=C\c1ccc(/C=C/c2ccc3cc(N4CCCC4)ccc3c2)cc1)C(=O)O,CCO,422.0
N#C/C(=C\c1ccc(/C=N/N(c2ccccc2)c2ccccc2)s1)C(=O)O,C1CCOC1,465.0
N#C/C(=C\c1ccc(C#CC2=CC3=N/C2=C(/c2ccccc2OC2CCCCC2)c2ccc4n2[Zn]n2/c(cc/c2=C/3c2ccccc2OC2CCCCC2)=C(/c2ccccc2OC2CCCCC2)C2=N/C(=C\4c3ccccc3OC3CCCCC3)C=C2)cc1)C(=O)O,C1CCOC1,606.0
N#C/C(=C\c1ccc(C#Cc2c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccccc4)s3)c3ccccc23)s1)C(=O)O,CCO,469.0
N#C/C(=C\c1ccc(C#Cc2ccc(C#Cc3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc2)cc1)C(=O)O,ClCCl,405.0
N#C/C(=C\c1ccc(C#N)cc1)c1nc(-c2ccc(Cl)cc2)c(-c2ccccc2)s1,CC#N,377.0
N#C/C(=C\c1ccc(C#N)cc1)c1nc(-c2ccc(Cl)cc2)cs1,CC#N,367.0
N#C/C(=C\c1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,CC#N,370.0
N#C/C(=C\c1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,CCO,375.0
N#C/C(=C\c1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,CN(C)C=O,376.0
N#C/C(=C\c1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,Cc1ccccc1,380.0
N#C/C(=C\c1ccc(C#N)cc1)c1nc(-c2ccccc2)cs1,ClCCl,375.0
N#C/C(=C\c1ccc(C(=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)c2ccccc2)cc1)C(=O)O,ClCCl,439.0
N#C/C(=C\c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc(Cl)cc2)cs1,CC#N,359.0
N#C/C(=C\c1ccc(C=C(c2ccccc2)c2ccccc2)cc1)c1ccccc1,C1CCOC1,366.0
N#C/C(=C\c1ccc(C=C2C=C(c3ccc(Cl)cc3)OC(c3ccc(Cl)cc3)=C2)cc1)C(=O)O,ClCCl,488.0
N#C/C(=C\c1ccc(C=C2C=C(c3ccc(F)cc3)OC(c3ccc(F)cc3)=C2)cc1)C(=O)O,ClCCl,491.0
N#C/C(=C\c1ccc(C=C2C=C(c3ccc(I)cc3)OC(c3ccc(I)cc3)=C2)cc1)C(=O)O,ClCCl,487.0
N#C/C(=C\c1ccc(C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)cc1)C(=O)O,ClCCl,497.0
N#C/C(=C\c1ccc(C=Cc2ccc(N(c3ccc(-c4ccc(C(=C(c5ccccc5)c5ccccc5)c5ccccc5)cc4)cc3)c3ccc(-c4ccc(C(=C(c5ccccc5)c5ccccc5)c5ccccc5)cc4)cc3)cc2)o1)C(=O)O,ClCCl,475.0
N#C/C(=C\c1ccc(C=Cc2ccc(N(c3ccc(-c4ccc(C(=C(c5ccccc5)c5ccccc5)c5ccccc5)cc4)cc3)c3ccc(-c4ccc(C(=C(c5ccccc5)c5ccccc5)c5ccccc5)cc4)cc3)cc2)s1)C(=O)O,ClCCl,480.0
N#C/C(=C\c1ccc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)o1)C(=O)O,C1CCOC1,469.0
N#C/C(=C\c1ccc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,CC#N,463.0
N#C/C(=C\c1ccc(Cl)cc1)c1nc(-c2ccccc2)c(-c2ccccc2)s1,CC#N,365.0
N#C/C(=C\c1ccc(Cl)cc1)c1nc(-c2ccccc2)cs1,CC#N,364.0
N#C/C(=C\c1ccc(Cl)cc1)c1nc2ccccc2s1,C1CCCCC1,350.0
N#C/C(=C\c1ccc(Cl)cc1)c1nc2ccccc2s1,CO,350.0
N#C/C(=C\c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5ccc6cccc7ccc4c5c67)cc3)cc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,C1CCOC1,410.0
N#C/C(=C\c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5ccc6cccc7ccc4c5c67)cc3)cc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,CC#N,400.0
N#C/C(=C\c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5ccc6cccc7ccc4c5c67)cc3)cc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,CO,403.0
N#C/C(=C\c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5ccc6cccc7ccc4c5c67)cc3)cc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,Cc1ccccc1,411.0
N#C/C(=C\c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5ccc6cccc7ccc4c5c67)cc3)cc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,ClCCl,409.0
N#C/C(=C\c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)C(=O)O,ClC(Cl)Cl,458.0
N#C/C(=C\c1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)cc1)C(=O)O,CCO,410.0
N#C/C(=C\c1ccc(N(c2ccc(/C=C(\C#N)c3ccc(C#N)cc3)cc2)c2ccc(/C=C(\C#N)c3ccc(C#N)cc3)cc2)cc1)c1ccc(C#N)cc1,C1CCOC1,440.0
N#C/C(=C\c1ccc(N(c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2)c2ccc(/C=C/C(=O)O)cc2)cc1)c1ccc([N+](=O)[O-])cc1,C1CCOC1,576.0
N#C/C(=C\c1ccc(N(c2ccc(C#Cc3ccccc3)cc2)c2ccc(C#Cc3ccccc3)cc2)cc1)C(=O)O,CCO,410.0
N#C/C(=C\c1ccc(N(c2ccc(C=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(C=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)C(=O)O,C1CCOC1,407.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccc(-c3cc4c5c(c3)CCCN5CCC4)cc2)cc1)C(=O)O,CCO,410.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,C1CCOC1,411.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,CC#N,420.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,CO,405.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,Cc1ccccc1,431.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)cc1)C(=O)O,ClCCl,431.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,CC#N,422.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,CO,407.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClCCl,438.0
N#C/C(=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(C#N)cc1,C1CCOC1,420.0
N#C/C(=C\c1ccc(N(c2ccccn2)c2ccccn2)cc1)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CN(C)C=O,468.0
N#C/C(=C\c1ccc(N(c2ccccn2)c2ccccn2)s1)c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)s1,CN(C)C=O,534.0
N#C/C(=C\c1ccc(N2c3ccccc3Sc3ccccc32)cc1)C(=O)O,ClCCl,408.0
N#C/C(=C\c1ccc(O)c(O)c1)c1ccc(-c2ccc(-c3cccs3)s2)s1,CCO,429.0
N#C/C(=C\c1ccc(O)c(O)c1)c1ccc(-c2cccs2)s1,CCO,411.0
N#C/C(=C\c1ccc(O)c(O)c1)c1cccs1,CCO,372.0
N#C/C(=C\c1ccc(OCCCCCCOc2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2O)c(O)c1)c1ccc([N+](=O)[O-])cc1,C1CCOC1,605.0
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)c1ccc(N(c2ccc(/C=C\C(=O)O)cc2)c2ccc(/C=C\C(=O)O)cc2)cc1,C1CCOC1,556.0
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)cs1,CC#N,382.0
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,C1CCCCC1,360.0
N#C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,CO,360.0
N#C/C(=C\c1ccc2c(c1)-c1cc(N(c3ccccc3)c3ccccc3)ccc1C21c2cc(/C=C(\C#N)C(=O)O)ccc2-c2ccc(N(c3ccccc3)c3ccccc3)cc21)C(=O)O,CC#N,392.0
N#C/C(=C\c1ccc2c(c1)C(CCCOC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)(CCCOC(C(F)(F)F)(C(F)(F)F)C(F)(F)F)c1cc(N(c3ccccc3)c3ccccc3)ccc1-2)C(=O)O,CCO,425.0
N#C/C(=C\c1ccc2c(c1)Oc1ccccc1N2CCCCCCN1c2ccccc2Oc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,C1CCOC1,476.0
N#C/C(=C\c1ccc2c(c1)Sc1cc(Nc3ccc4c(c3)C(=O)/C(=C3\Sc5ccccc5C3=O)S4)ccc1N2c1ccccc1)C(=O)O,CCO,492.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCCCCCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,CN(C)C=O,400.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCCCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,CN(C)C=O,402.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,CN(C)C=O,402.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,CN(C)C=O,416.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,C1CCOC1,435.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,CN(C)C=O,399.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,C1CCOC1,433.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2CCCCN1c2ccccc2Sc2cc(/C=C(\C#N)C(=O)O)ccc21)C(=O)O,CN(C)C=O,396.0
N#C/C(=C\c1ccc2c(c1)Sc1ccccc1N2Cc1ccc(CN2c3ccccc3Sc3cc(/C=C(\C#N)C(=O)O)ccc32)cc1)C(=O)O,C1CCOC1,439.0
N#C/C(=C\c1ccc2c(c1)c1ccccc1n2-c1ccc(C#N)cc1)C(=O)O,CC#N,389.0
N#C/C(=C\c1ccc2c(c1)c1ccccc1n2-c1ccc(C(F)(F)F)cc1)C(=O)O,CC#N,394.0
N#C/C(=C\c1ccc2c(c1)c1ccccc1n2-c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,CC#N,416.0
N#C/C(=C\c1ccc2ccccc2c1-c1cccc2c1C(=O)/C(=C1/Nc3ccccc3C1=O)N2)C(=O)O,C1CCOC1,572.0
N#C/C(=C\c1ccc2ccccc2c1-c1cccc2c1C(=O)/C(=C1\Nc3ccccc3C1=O)N2)C(=O)O,C1CCOC1,572.0
N#C/C(=C\c1ccc2ccccc2c1-c1cccc2c1C(=O)/C(=C1\Sc3ccccc3C1=O)S2)C(=O)O,C1CCOC1,492.0
N#C/C(=C\c1ccc2sc(-c3ccc4c(c3)CCN4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)nc2c1)C(=O)O,ClCCl,410.0
N#C/C(=C\c1cccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)c1)C(=O)O,C1CCOC1,377.0
N#C/C(=C\c1cccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)c1)C(=O)O,CC#N,376.0
N#C/C(=C\c1cccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)c1)C(=O)O,CO,376.0
N#C/C(=C\c1cccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)c1)C(=O)O,Cc1ccccc1,379.0
N#C/C(=C\c1cccc(N(c2ccccc2)c2ccc3ccc4cccc5ccc2c3c45)c1)C(=O)O,ClCCl,377.0
N#C/C(=C\c1ccccc1)c1nc2ccccc2s1,C1CCCCC1,350.0
N#C/C(=C\c1ccccc1)c1nc2ccccc2s1,CO,350.0
N#C/C(=C\c1ccncc1)c1nc(-c2ccc(Cl)cc2)cs1,CC#N,357.0
N#C/C(=C\c1ccncc1)c1nc(-c2ccccc2)cs1,CC#N,361.0
N#C/C(=C\c1ccncc1)c1nc(-c2ccccc2)cs1,CCO,370.0
N#C/C(=C\c1ccncc1)c1nc(-c2ccccc2)cs1,CN(C)C=O,368.0
N#C/C(=C\c1ccncc1)c1nc(-c2ccccc2)cs1,CS(C)=O,371.0
N#C/C(=C\c1ccncc1)c1nc(-c2ccccc2)cs1,Cc1ccccc1,372.0
N#C/C(=C\c1ccncc1)c1nc(-c2ccccc2)cs1,ClCCl,418.0
N#C/C(=C\c1cn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc12)C(=O)O,CCO,375.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,C1CCOC1,378.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,C1COCCO1,379.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,CCOC(C)=O,375.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,CN(C)C=O,376.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,CS(C)=O,375.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,Cc1ccccc1,383.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1,ClC(Cl)Cl,382.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,C1CCOC1,381.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,C1COCCO1,381.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,CCO,380.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,CCOC(C)=O,380.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,CN(C)C=O,388.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,CO,377.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,CS(C)=O,382.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,Cc1ccccc1,387.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,ClC(Cl)Cl,383.0
N#C/C(=C\c1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,ClCCl,380.0
N#C/C(=C\c1ncc2cc(N(c3ccccc3)c3ccccc3)ccc2n1)C(=O)O,ClC(Cl)Cl,434.0
N#C/C(=C\c1sc(-c2ccc(-c3ccc(N(c4ccc5c(c4)OCCO5)c4ccc5c(c4)OCCO5)cc3)s2)c2c1OCCO2)C(=O)O,CN(C)C=O,524.0
N#C/C(=C\c1sc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)c2c1OCCO2)C(=O)O,CN(C)C=O,514.0
N#C/C(=C\c1sc(-c2ccc(F)cc2F)c2c1OCCO2)C(=O)O,CN(C)C=O,376.0
N#C/C(=C\c1sc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)c2c1OCCO2)C(=O)O,ClCCl,486.0
N#C/C(=C\c1sc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc2)c2c1OCCO2)C(=O)O,CN(C)C=O,492.0
N#C/C(=C\c1sc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2c1O[C@@H](COCCCCCCCCOC[C@H]1COc3c(/C=C(\C#N)C(=O)O)sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3O1)CO2)C(=O)O,ClC(Cl)Cl,494.0
N#C/C(=C\c1sc(/C=C(\C#N)C(=O)O)c(-c2cccc(N(c3ccccc3)c3ccccc3)c2)c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClC(Cl)Cl,307.0
N#C/C(=C\c1sc(/C=N/N(c2ccccc2)c2ccccc2)c2c1OCCO2)C(=O)O,C1CCOC1,490.0
N#C/C(C(=O)O)=C1/c2ccccc2-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc21,C1CCOC1,540.0
N#C/C(C(=O)O)=C1\C=C(/C=C/c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)CCC1,ClCCl,480.0
N#C/C(C(=O)O)=c1/s/c(=C\c2ccc(N3c4ccccc4C4CCCC43)s2)c(=O)n1CC(=O)O,ClC(Cl)Cl,550.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,C1CCOC1,372.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,C1COCCO1,372.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,C=CC#N,370.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,CC#N,371.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,CC(C)=O,369.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,CCCCCC,368.5
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,CCOC(C)=O,371.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,CO,371.0
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,Cc1ccccc1,371.5
N#C/C=C/c1ccc2ccc3cccc4ccc1c2c34,ClCCl,373.0
N#CC(/N=C/c1c(O)ccc2ccccc12)=C(C#N)/N=C/c1c(O)ccc2ccccc12,CC#N,520.0
N#CC(/N=C/c1ccccc1O)=C(C#N)/N=C/c1ccccc1O,CC#N,374.0
N#CC(=C(C#N)c1ccc(-n2c(-c3ccccc3)cc3ccccc32)cc1)c1ccc(-n2c(-c3ccccc3)cc3ccccc32)cc1,C1CCOC1,644.0
N#CC(=CC#Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClCCl,466.0
N#CC(=CC1COc2c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)sc(COCCCCCCCCOCc3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OC(C=C(C#N)C(=O)O)CO4)c2O1)C(=O)O,ClC(Cl)Cl,488.0
N#CC(=CC1COc2c(COCCCCCCCCOCc3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCC(C=C(C#N)C(=O)O)O4)sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c2O1)C(=O)O,ClC(Cl)Cl,501.0
N#CC(=CCCc1ccc(O)c(O)c1)C(=O)NCc1ccccc1,CC#N,263.0
N#CC(=C\c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)/C=N/O,ClCCl,426.0
N#CC(=Cc1c(F)cc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)cc1F)C(=O)O,ClCCl,430.0
N#CC(=Cc1c2ccccc2cc2ccccc12)c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1,C1CCOC1,401.0
N#CC(=Cc1c2ccccc2cc2ccccc12)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,403.0
N#CC(=Cc1cc(-c2ccc(C=C(C#N)c3ccc(-c4ccc(Cl)cc4)cc3)cc2)cs1)c1ccccc1,C1CCOC1,366.0
N#CC(=Cc1cc(-c2ccc(C=C(C#N)c3ccc(-c4ccc5ccccc5c4)cc3)cc2)cs1)c1ccccc1,C1CCOC1,361.0
N#CC(=Cc1cc(-c2ccc(C=C(C#N)c3ccc(-c4ccccc4)cc3)cc2)cs1)c1ccccc1,C1CCOC1,366.0
N#CC(=Cc1cc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,C1CCOC1,430.0
N#CC(=Cc1cc2sc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)c4nc(-c5ccccc5)c(-c5ccccc5)nc34)cc2s1)C(=O)O,CN(C)C=O,503.0
N#CC(=Cc1cc2sc(-c3ccco3)cc2s1)C(=O)O,CCO,398.0
N#CC(=Cc1cc2sc(-c3cccs3)cc2s1)C(=O)O,CCO,399.0
N#CC(=Cc1ccc(-c2c(F)c(F)c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3n[nH]nc23)s1)C(=O)O,C1CCOC1,462.0
N#CC(=Cc1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,C1CCOC1,443.0
N#CC(=Cc1ccc(-c2cc(C(=O)O)c(-c3ccc(/C=C(\C#N)c4ccc([N+](=O)[O-])cc4)s3)cc2C(=O)O)s1)c1ccc([N+](=O)[O-])cc1,C1CCOC1,636.0
N#CC(=Cc1ccc(-c2ccc(-c3c4c5ccccc5oc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)c-4c4ccccc34)s2)s1)C(=O)O,ClC(Cl)Cl,414.0
N#CC(=Cc1ccc(-c2ccc(-c3c4c5ccccc5oc(-c5ccc(N6CCCC6)cc5)c-4c4ccccc34)s2)s1)C(=O)O,ClC(Cl)Cl,408.0
N#CC(=Cc1ccc(-c2ccc(-c3c4c5ccccc5oc(-c5ccccc5)c-4c4ccccc34)s2)s1)C(=O)O,ClC(Cl)Cl,442.0
N#CC(=Cc1ccc(-c2ccc(-c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)s1)C(=O)O,C1CCOC1,456.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(-c4cc5c6c(c4)CCCN6CCC5)s3)s2)s1)C(=O)O,C1CCOC1,484.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(-c4ccc(-n5c6ccc(-c7ccc(C=Cc8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)cc6c6cc(-c7ccc(C=Cc8ccc(N(c9ccccc9)c9ccccc9)cc8)cc7)ccc65)cc4)s3)c3nsnc23)s1)C(=O)O,CN(C)C=O,498.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)s1)C(=O)O,ClC(Cl)Cl,503.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(-c4ccc5c(c4)C4CCCC4N5c4ccc(C=C(c5ccccc5)c5ccccc5)cc4)s3)s2)s1)C(=O)O,ClC(Cl)Cl,519.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3nsnc23)s1)C(=O)O,C1CCOC1,445.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)c3nc(-c4ccccc4)c(-c4ccccc4)nc23)s1)C(=O)O,CN(C)C=O,457.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)s2)cc1)C(=O)O,C1CCOC1,434.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3n[se]nc23)s1)C(=O)O,C1CCOC1,502.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)s1)C(=O)O,C1CCOC1,491.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)cc1)C(=O)O,C1CCOC1,427.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,C1CCOC1,472.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,ClC(Cl)Cl,460.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,ClCCl,405.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)c3n[se]nc23)s1)C(=O)O,C1CCOC1,544.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccccc3)c3nsnc23)s1)C(=O)O,C1CCOC1,474.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c3nsnc23)s1)C(=O)O,C1CCOC1,459.0
N#CC(=Cc1ccc(-c2ccc(-c3ccc4ccc5cccc6ccc3c4c56)s2)s1)C(=O)O,C1CCOC1,524.0
N#CC(=Cc1ccc(-c2ccc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCCO4)s2)s1)C(=O)O,C1CCOC1,510.0
N#CC(=Cc1ccc(-c2ccc(-n3c4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4c4cc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)ccc43)s2)s1)C(=O)O,CN(C)C=O,535.0
N#CC(=Cc1ccc(-c2ccc(-n3c4ccc(-c5ccc(C=Cc6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)cc4c4cc(-c5ccc(C=Cc6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5)ccc43)s2)s1)C(=O)O,CN(C)C=O,479.0
N#CC(=Cc1ccc(-c2ccc(/C(C#N)=C/c3ccc(-n4c5ccc(-n6c7ccccc7c7ccccc76)cc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)s2)s1)C(=O)O,ClCCl,462.0
N#CC(=Cc1ccc(-c2ccc(C#Cc3ccc(-n4c5ccccc5c5ccccc54)cc3)c3nsnc23)cc1)C(=O)O,ClC(Cl)Cl,418.0
N#CC(=Cc1ccc(-c2ccc(C(=C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)C(=O)O,ClCCl,311.0
N#CC(=Cc1ccc(-c2ccc(C(=C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)o1)C(=O)O,ClCCl,310.0
N#CC(=Cc1ccc(-c2ccc(C(=C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)s1)C(=O)O,ClCCl,309.0
N#CC(=Cc1ccc(-c2ccc(C(=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)c3ccc(-c4ccc(C=C(C#N)C(=O)O)cc4)cc3)cc2)cc1)C(=O)O,CCO,404.0
N#CC(=Cc1ccc(-c2ccc(C(=C3C=C(c4ccccc4)OC(c4ccccc4)=C3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,439.0
N#CC(=Cc1ccc(-c2ccc(C(C#N)=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)C(=O)O,ClC(Cl)Cl,437.0
N#CC(=Cc1ccc(-c2ccc(C(C#N)=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)o1)C(=O)O,ClC(Cl)Cl,425.0
N#CC(=Cc1ccc(-c2ccc(C(C#N)=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)s1)C(=O)O,ClC(Cl)Cl,453.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3)c3ccc(-c4ccc(C=C(C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,ClC(Cl)Cl,484.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)s1)C(=O)O,C1CCOC1,411.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccc(Br)cc3)c3ccc(-c4ccc(/C=C(\C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,CO,460.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccc(Br)cc3)c3ccc(Br)cc3)cc2)s1)C(=O)O,CO,440.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc2)cc1)C(=O)O,CN(C)C=O,423.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)s1)C(=O)O,C1CCOC1,447.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccc4c(c3)OCCO4)c3ccc4c(c3)OCCO4)cc2)o1)C(=O)O,ClCCl,502.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,426.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)o1)C(=O)O,ClCCl,486.0
N#CC(=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)s2)c2nsnc12)C(=O)O,ClCCl,613.0
N#CC(=Cc1ccc(-c2ccc(N3c4ccccc4C=Cc4ccccc43)cc2)s1)C(=O)O,ClCCl,470.0
N#CC(=Cc1ccc(-c2ccc(N3c4ccccc4CCc4ccccc43)cc2)s1)C(=O)O,ClCCl,422.0
N#CC(=Cc1ccc(-c2ccc3c(c2)C2CCCC2N3c2ccc3c(c2)Cc2ccccc2-3)cc1)C(=O)O,CN(C)C=O,397.0
N#CC(=Cc1ccc(-c2ccc3c(c2)C2CCCC2N3c2ccc3c(c2)Cc2ccccc2-3)s1)C(=O)O,CN(C)C=O,435.0
N#CC(=Cc1ccc(-c2ccc3c(c2)Sc2ccccc2N3CCCCCCn2c3ccccc3c3cc(-c4ccc(C=C(C#N)C(=O)O)s4)ccc32)s1)C(=O)O,CN(C)C=O,397.0
N#CC(=Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,CCO,406.0
N#CC(=Cc1ccc(-c2ccc3c4c(cccc24)-c2c-3c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccccc3c2-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,417.0
N#CC(=Cc1ccc(-c2ccc3c4c(cccc24)-c2c-3c(-c3ccccc3)c3ccccc3c2-c2ccccc2)s1)C(=O)O,ClCCl,445.0
N#CC(=Cc1ccc(-c2ccc3ccc4cccc5ccc2c3c45)o1)C(=O)O,C1CCOC1,429.0
N#CC(=Cc1ccc(-c2ccc3ccc4cccc5ccc2c3c45)s1)C(=O)O,C1CCOC1,483.4
N#CC(=Cc1ccc(-c2cnc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3nsnc23)cc1)C(=O)O,C1CCOC1,518.0
N#CC(=Cc1ccc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nccnc23)s1)C(=O)O,ClCCl,524.0
N#CC(=Cc1ccc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1)C(=O)O,C1CCOC1,497.0
N#CC(=Cc1ccc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1)C(=O)O,ClCCl,500.0
N#CC(=Cc1ccc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)o1)C(=O)O,C1CCOC1,536.0
N#CC(=Cc1ccc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)c3nsnc23)cc1)C(=O)O,ClCCl,575.0
N#CC(=Cc1ccc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)s3)c3nsnc23)s1)C(=O)O,ClCCl,620.0
N#CC(=Cc1ccc(-c2nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1)C(=O)O,CN(C)C=O,396.0
N#CC(=Cc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1)C(=O)O,CCO,368.0
N#CC(=Cc1ccc(-c2nc(Cl)nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1)C(=O)O,CN(C)C=O,397.0
N#CC(=Cc1ccc(-c2ncc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)c3nsnc23)cc1)C(=O)O,C1CCOC1,526.0
N#CC(=Cc1ccc(-c2ncc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1)C(=O)O,C1CCOC1,498.0
N#CC(=Cc1ccc(-c2ncc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)o1)C(=O)O,C1CCOC1,522.0
N#CC(=Cc1ccc(-c2ncc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)s1)C(=O)O,C1CCOC1,548.0
N#CC(=Cc1ccc(-c2ncc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)s1)C(=O)O,ClCCl,546.0
N#CC(=Cc1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)o2)cc1)C(=O)O,CC#N,397.0
N#CC(=Cc1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)o2)cc1)C(=O)O,CCCCCC,397.0
N#CC(=Cc1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)o2)cc1)C(=O)O,CO,397.0
N#CC(=Cc1ccc(-c2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2-c2ccc(/C=C(/C#N)C(=O)O)cc2)cc1)C(=O)O,C1CCOC1,451.0
N#CC(=Cc1ccc(-c2sc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2-c2ccc(/C=C(/C#N)C(=O)O)s2)s1)C(=O)O,C1CCOC1,478.0
N#CC(=Cc1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)c3c2OCCO3)cc1)C(=O)O,C1CCOC1,456.0
N#CC(=Cc1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)c3c2OCCO3)cc1C(F)(F)F)C(=O)O,C1CCOC1,458.0
N#CC(=Cc1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)c3c2OCCO3)cc1F)C(=O)O,C1CCOC1,442.0
N#CC(=Cc1ccc(-c2sc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2-c2ccc(/C=C(/C#N)C(=O)O)s2)s1)C(=O)O,C1CCOC1,472.0
N#CC(=Cc1ccc(-n2c3ccccc3c3ccccc32)cc1)C(=O)O,C1CCOC1,340.0
N#CC(=Cc1ccc(-n2c3ccccc3c3ccccc32)cc1)C(=O)O,CC#N,374.0
N#CC(=Cc1ccc(-n2c3ccccc3c3ccccc32)cc1)C(=O)O,ClC(Cl)Cl,388.0
N#CC(=Cc1ccc(-n2c3ccccc3c3ccccc32)s1)C(=O)O,C1CCOC1,400.0
N#CC(=Cc1ccc(/C=C/c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1)C(=O)O,CC#N,445.0
N#CC(=Cc1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,438.0
N#CC(=Cc1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1-c1c(F)c(F)c(F)c(F)c1F)C(=O)O,ClCCl,493.0
N#CC(=Cc1ccc(/C=N/N(c2ccccc2)c2ccccc2)o1)C(=O)O,C1CCOC1,452.0
N#CC(=Cc1ccc(C#C/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccccc2)=C2/C=CC(=N2)/C=4N(c2ccccc2)c2ccccc2)cc1)C(=O)O,C1CCOC1,453.0
N#CC(=Cc1ccc(C#Cc2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1)C(=O)O,ClC(Cl)Cl,375.0
N#CC(=Cc1ccc(C#Cc2ccc(N(c3ccc(C#Cc4ccc(/C=C(/C#N)C(=O)O)cc4)cc3)c3ccc(C#Cc4ccc(O/C=C(\C#N)C(=O)O)cc4)cc3)cc2)cc1)C(=O)O,ClC(Cl)Cl,440.0
N#CC(=Cc1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c1)C(=O)O,ClC(Cl)Cl,418.0
N#CC(=Cc1ccc(C#Cc2ccc3c4c(cccc24)-c2c-3c(-c3ccccc3)c3ccccc3c2-c2ccccc2)cc1)C(=O)O,ClCCl,433.0
N#CC(=Cc1ccc(C#Cc2ccc3ccc4cccc5ccc2c3c45)o1)C(=O)O,C1CCOC1,425.0
N#CC(=Cc1ccc(C(=O)O)cc1)c1ccc([N+](=O)[O-])cc1,C1CCOC1,617.0
N#CC(=Cc1ccc(C(C#N)=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,C1CCOC1,478.0
N#CC(=Cc1ccc(C(C#N)=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,Cc1ccccc1,505.0
N#CC(=Cc1ccc(C(C#N)=Cc2ccc(N(c3ccccc3)c3ccccc3)s2)s1)C(=O)O,C1CCOC1,524.0
N#CC(=Cc1ccc(C(C#N)=Cc2ccc(N(c3ccccc3)c3ccccc3)s2)s1)C(=O)O,Cc1ccccc1,550.0
N#CC(=Cc1ccc(C2=NC(c3ccccc3)C(c3ccccc3)N2)cc1)C(=O)O,C1CCOC1,366.0
N#CC(=Cc1ccc(C2=NC(c3ccccc3)C(c3ccccc3)N2)cc1)C(=O)O,CN(C)C=O,366.0
N#CC(=Cc1ccc(C2CC3C(=C4SC(c5ccc(N(c6ccccc6)c6ccccc6)cc5)CC4C4C5CCCC4OCCCCCCOC4CCCC(OCCCCCCO5)C43)S2)s1)C(=O)O,ClCCl,551.0
N#CC(=Cc1ccc(C2CC3C(=C4SC(c5ccc6c7ccccc7n(-c7ccccc7)c6c5)CC4C4C5CCCC4OCCCCCCOC4CCCC(OCCCCCCO5)C43)S2)s1)C(=O)O,ClCCl,570.0
N#CC(=Cc1ccc(C2SC(c3ccc(C=C(C#N)C(=O)O)s3)C3NSNC23)s1)C(=O)O,CS(C)=O,600.0
N#CC(=Cc1ccc(C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)s1)C(=O)O,ClCCl,556.0
N#CC(=Cc1ccc(C=Cc2c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccccc23)cc1)C(=O)O,ClCCl,418.0
N#CC(=Cc1ccc(C=Cc2ccc(N(c3ccccc3)c3ccc(/C=C/c4ccc(C=C(C#N)C(=O)O)s4)cc3)cc2)s1)C(=O)O,CCO,468.0
N#CC(=Cc1ccc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,C1CCOC1,476.0
N#CC(=Cc1ccc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,CCO,441.0
N#CC(=Cc1ccc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)s1)C(=O)O,ClCCl,490.0
N#CC(=Cc1ccc(C=Cc2ccc(N3c4ccccc4C=Cc4ccccc43)cc2)s1)C(=O)O,ClCCl,498.0
N#CC(=Cc1ccc(N(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)cc1)C(=O)O,CCO,410.0
N#CC(=Cc1ccc(N(c2ccc(-n3c4ccccc4c4ccccc43)cc2)c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1)C(=O)O,CC#N,424.0
N#CC(=Cc1ccc(N(c2ccc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1)C(=O)O,ClCCl,360.0
N#CC(=Cc1ccc(N(c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2)c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2)cc1)C(=O)O,ClCCl,401.0
N#CC(=Cc1ccc(N(c2ccc(C#Cc3ccccc3)cc2)c2ccc(C#Cc3ccccc3)cc2)cc1)C(=O)O,CCO,410.0
N#CC(=Cc1ccc(N(c2ccc(C#Cc3ccccn3)cc2)c2ccc(C#Cc3ccccn3)cc2)cc1)C(=O)O,ClCCl,435.0
N#CC(=Cc1ccc(N(c2ccc(C#Cc3cccnc3)cc2)c2ccc(C#Cc3cccnc3)cc2)cc1)C(=O)O,ClCCl,443.0
N#CC(=Cc1ccc(N(c2ccc(C=Cc3ccccc3)cc2)c2ccc(C=Cc3ccccc3)cc2)cc1)C(=O)O,CCO,424.0
N#CC(=Cc1ccc(N(c2ccc(N3c4ccccc4Sc4ccccc43)cc2)c2ccc(N3c4ccccc4Sc4ccccc43)cc2)cc1)C(=O)O,CC#N,422.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccc(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc2)cc1)C(=O)O,CN(C)C=O,390.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccc(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc2)cc1)c1ccc([N+](=O)[O-])cc1,CN(C)C=O,465.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccc(-c3nc4cc5sc(=S)sc5cc4[nH]3)cc2)cc1)C(=O)O,CCO,410.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccc(-c3nc4ccccc4[nH]3)cc2)cc1)C(=O)O,CCO,421.0
N#CC(=Cc1ccc(N(c2ccccc2)c2cccc(C=C(C#N)c3nnn[nH]3)c2)cc1)c1nnn[nH]1,ClCCl,455.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(-c2ccc3ccccc3c2)cc1,C1CCCCC1,412.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1,C1CCCCC1,419.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(Br)cc1,C1CCCCC1,409.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,C1CCCCC1,403.0
N#CC(=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1nnn[nH]1,ClCCl,434.0
N#CC(=Cc1ccc2c(c1)C1CCCC1N2c1ccc2c(c1)Cc1ccccc1-2)C(=O)O,CN(C)C=O,396.0
N#CC(=Cc1ccc2c(c1)CCc1ccccc1N2c1ccc(N)cc1)C(=O)O,CC#N,421.0
N#CC(=Cc1ccc2c(c1)CCc1ccccc1N2c1ccc([N+](=O)[O-])cc1)C(=O)O,CC#N,409.0
N#CC(=Cc1ccc2c3c(cccc13)-c1c-2c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccccc2c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1)C(=O)O,ClCCl,447.0
N#CC(=Cc1ccc2ccccc2c1)c1ccc(N(c2ccccc2)c2ccc3ccccc3c2)cc1,C1CCOC1,412.0
N#CC(=Cc1ccc2ccccc2c1)c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1,C1CCOC1,404.0
N#CC(=Cc1ccc2ccccc2c1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,412.0
N#CC(=Cc1cccc(N(c2ccccc2)c2ccccc2)c1)C(=O)O,C1CCOC1,395.0
N#CC(=Cc1cccc2ccccc12)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,400.0
N#CC(=Cc1ccccc1)c1ccc(N(c2ccccc2)c2ccc3ccccc3c2)cc1,C1CCOC1,402.0
N#CC(=Cc1cn(-c2ccccc2)nc1-c1ccccc1)c1nc2ccccc2s1,Cc1ccccc1,383.0
N#CC(=Cc1cnc(C=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)s1)C(=O)O,ClC(Cl)Cl,533.0
N#CC(=Cc1sc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2c1OC(COCCCCCCCCOCC1COc3c(C=C(C#N)C(=O)O)sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3O1)CO2)C(=O)O,ClC(Cl)Cl,494.0
N#CC(=Cc1sc(C#CC2=CSC(=C3SC=CS3)S2)c2c1OCCO2)C(=O)O,CS(C)=O,391.0
N#CC(=Cc1sc(C#Cc2ccc3c(=C4SC=CS4)c4ccccc4c(=C4SC=CS4)c3c2)c2c1OCCO2)C(=O)O,CS(C)=O,419.0
N#CC(=Cc1sc(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c2c1OCCO2)C(=O)O,ClC(Cl)Cl,511.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,C1CCOC1,527.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,CC#N,540.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,CC(C)=O,535.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,CCOC(C)=O,523.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,CN(C)C=O,550.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,CO,541.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,Cc1ccccc1,526.0
N#CC(C#N)=C(/C=C/c1cc2c3c(c1)CCCN3CCC2)c1ccc2c3c(cccc13)CC2,ClC(Cl)Cl,538.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,C1CCOC1,485.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,CC#N,486.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,CC(C)=O,485.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,CCOC(C)=O,482.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,CN(C)C=O,493.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,CO,490.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,Cc1ccccc1,493.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc2c3c(cccc13)CC2,ClC(Cl)Cl,502.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,C1COCCO1,480.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CC#N,481.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CC(C)=O,481.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CCO,490.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CCOC(C)=O,478.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CN(C)C=O,490.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,CO,484.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,Cc1ccccc1,487.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,ClC(Cl)Cl,502.0
N#CC(C#N)=C(/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1,ClCCl,481.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,C1CCOC1,402.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,C1COCCO1,399.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,CCO,402.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,CCOC(C)=O,399.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,CN(C)C=O,405.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,CO,397.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,CS(C)=O,409.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,Cc1ccccc1,405.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,ClC(Cl)Cl,406.0
N#CC(C#N)=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1ccccc1,ClCCl,403.0
N#CC(C#N)=C(C#N)c1ccc(O)c(O)c1,C1CCOC1,422.0
N#CC(C#N)=C(C=Cc1c[nH]c2ccccc12)c1ccc(N)cc1,CO,447.0
N#CC(C#N)=C(c1ccc(-n2ccc3ccccc32)cc1)c1ccc(-n2ccc3ccccc32)cc1,Cc1ccccc1,400.0
N#CC(C#N)=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,367.2077922
N#CC(C#N)=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC(C)=O,370.4545455
N#CC(C#N)=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,374.025974
N#CC(C#N)=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,374.025974
N#CC(C#N)=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,381.4935065
N#CC(C#N)=C(c1cccc(N(c2ccccc2)c2ccccc2)c1)c1cccc(N(c2ccccc2)c2ccccc2)c1,C1CCCCC1,367.6948052
N#CC(C#N)=C(c1cccc(N(c2ccccc2)c2ccccc2)c1)c1cccc(N(c2ccccc2)c2ccccc2)c1,CC(C)=O,371.4285714
N#CC(C#N)=C(c1cccc(N(c2ccccc2)c2ccccc2)c1)c1cccc(N(c2ccccc2)c2ccccc2)c1,CN(C)C=O,374.8376623
N#CC(C#N)=C(c1cccc(N(c2ccccc2)c2ccccc2)c1)c1cccc(N(c2ccccc2)c2ccccc2)c1,Cc1ccccc1,374.8376623
N#CC(C#N)=C(c1cccc(N(c2ccccc2)c2ccccc2)c1)c1cccc(N(c2ccccc2)c2ccccc2)c1,ClC(Cl)Cl,382.1428571
N#CC(C#N)=C1C=C(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)OC(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)=C1,ClC(Cl)Cl,489.0
N#CC(C#N)=C1C=C(Nc2ccc([N+](=O)[O-])cc2)c2ccccc21,CC(C)=O,529.0
N#CC(C#N)=C1C=C(Nc2ccccc2)c2ccccc21,CC(C)=O,510.0
N#CC(C#N)=CC(=C(C#N)C#N)c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,600.0
N#CC(C#N)=CC(c1ccc(N(c2ccccc2)c2ccccc2)cc1)=c1ccc(=C(C#N)C#N)cc1,ClCCl,750.0
N#CC(C#N)=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=C(C#N)C#N)C1,ClC(Cl)Cl,467.0
N#CC(C#N)=CNc1cccc(F)c1,CS(C)=O,319.0
N#CC(C#N)=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)o1,ClCCl,426.0
N#CC(C#N)=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)o1,O,394.0
N#CC(C#N)=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)s1,CCO,421.0
N#CC(C#N)=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)s1,ClCCl,426.0
N#CC(C#N)=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)s1,O,388.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccc(-c4ccncc4)cc3)c3ccc(-c4ccc(C=C(C#N)C#N)s4)cc3)cc2)s1,CC#N,491.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccc(-c4ccncc4)cc3)c3ccc(-c4ccncc4)cc3)cc2)s1,CC#N,475.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(-c4ccc(C=C(C#N)C#N)s4)cc3)cc2)s1,C1CCOC1,484.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc2)cc1,CN(C)C=O,423.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc2)s1,C1CCOC1,460.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc2)s1,CN(C)C=O,478.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClC(Cl)Cl,461.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)o1,ClC(Cl)Cl,509.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1,ClC(Cl)Cl,506.0
N#CC(C#N)=Cc1ccc(-c2ccc(N(c3ccncc3)c3ccc(-c4ccc(C=C(C#N)C#N)s4)cc3)cc2)s1,CC#N,445.0
N#CC(C#N)=Cc1ccc(-c2ccc(O)c(-c3nc4ccccc4s3)c2)s1,ClCCl,427.0
N#CC(C#N)=Cc1ccc(-c2ccc(O)c(-c3nc4ccccc4s3)c2)s1,O,416.0
N#CC(C#N)=Cc1ccc(-c2cccc(-c3nc4ccccc4s3)c2O)o1,CCO,421.0
N#CC(C#N)=Cc1ccc(-c2cccc(-c3nc4ccccc4s3)c2O)o1,ClCCl,428.0
N#CC(C#N)=Cc1ccc(-c2cccc(-c3nc4ccccc4s3)c2O)o1,O,443.0
N#CC(C#N)=Cc1ccc(-c2cccc(-c3nc4ccccc4s3)c2O)s1,ClCCl,424.0
N#CC(C#N)=Cc1ccc(-c2cccc(-c3nc4ccccc4s3)c2O)s1,O,397.0
N#CC(C#N)=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,C1CCOC1,496.0
N#CC(C#N)=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CC#N,491.0
N#CC(C#N)=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CCCCCC,497.0
N#CC(C#N)=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CS(C)=O,499.0
N#CC(C#N)=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,Cc1ccccc1,499.0
N#CC(C#N)=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,ClCCl,506.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,C1CCCCC1,429.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,C1CCOC1,441.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CC(C)=O,439.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CCCCCC,422.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CCOC(C)=O,436.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CN(C)C=O,447.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CS(C)=O,452.0
N#CC(C#N)=Cc1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,Cc1ccccc1,449.0
N#CC(C#N)=Cc1ccc([N+](=O)[O-])cc1,CO,310.0
N#CC(C#N)=Cc1ccc2c(c1)[nH]c1c3ccccc3ccc21,ClCCl,436.0
N#CC(C#N)=Cc1ccc2c(c1)[nH]c1c3ccccc3sc21,ClCCl,445.0
N#CC(C#N)=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,CC#N,395.0
N#CC(C#N)=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,CCCCC,393.0
N#CC(C#N)=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,Cc1ccccc1,402.0
N#CC(C#N)=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,ClCCl,406.0
N#CC(C#N)=Cc1ccc2c(c1)c1ccccc1n2-c1cccc2ccccc12,ClCCl,404.0
N#CC(C#N)=Cc1ccc2nc(C#Cc3ccc(N(c4ccc(C#Cc5nc6ccc(C=C(C#N)C#N)cc6s5)cc4)c4ccc(C#Cc5nc6ccc(C=C(C#N)C#N)cc6s5)cc4)cc3)sc2c1,Cc1ccccc1,440.0
N#CC(C#N)=Cc1ccc2nc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)sc2c1,Cc1ccccc1,457.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,C1CCOC1,346.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,C1COCCO1,346.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CCO,346.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CCOC(C)=O,346.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CN(C)C=O,347.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,CO,345.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,Cc1ccccc1,356.0
N#CC(C#N)=Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,352.0
N#CC(C#N)=Cc1nc2ccc(C#Cc3ccc(N(c4ccc(C#Cc5ccc6nc(C=C(C#N)C#N)sc6c5)cc4)c4ccc(C#Cc5ccc6nc(C=C(C#N)C#N)sc6c5)cc4)cc3)cc2s1,Cc1ccccc1,480.0
N#CC(C#N)=Cc1nc2ccc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2s1,Cc1ccccc1,494.0
N#CC(C#N)=Cc1sc(-c2ccc(N(c3ccc(C(=O)O)cc3)c3ccc(C(=O)O)cc3)cc2)c2c1OCCO2,CN(C)C=O,492.0
N#CC(C#N)=c1[nH]c(=O)/c(=C/c2ccc(-c3ccc(N(c4ccccc4)c4ccc(-c5ccc(/C=c6\sc(=C(C#N)C#N)[nH]c6=O)s5)cc4)cc3)s2)s1,CCO,489.0
N#CC(C#N)=c1[nH]c(=O)/c(=C/c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1,CCO,471.0
N#CC(C#N)=c1[nH]c(=O)/c(=C/c2ccc(N(c3ccc(/C=c4\sc(=C(C#N)C#N)[nH]c4=O)cc3)c3ccc(/C=c4/sc(=C(C#N)C#N)[nH]c4=O)cc3)cc2)s1,CCO,454.0
N#CC(C#N)=c1[nH]c(=O)/c(=C/c2ccc(N(c3ccccc3)c3ccc(/C=c4\sc(=C(C#N)C#N)[nH]c4=O)cc3)cc2)s1,CCO,455.0
N#CC(C#N)=c1[nH]c(=O)/c(=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)s1,CCO,435.0
N#CC(C#N)=c1s/c(=C\c2ccc(N3c4ccccc4C4CCCC43)s2)c(=O)n1CC(=O)O,ClC(Cl)Cl,558.0
N#CC(C(=O)O)=C1C=C(/C=C/c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2)CC(/C=C/c2ccc(/C=C(\C#N)c3ccc([N+](=O)[O-])cc3)cc2)=C1,C1CCOC1,610.0
N#CC(C(=O)O)=C1C=C(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)OC(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)=C1,ClCCl,460.0
N#CC(C(=O)O)=C1c2ccc(N(c3ccccc3)c3ccccc3)cc2-c2cc(N(c3ccccc3)c3ccccc3)ccc21,ClCCl,449.0
N#CC1(N)CC(c2ccccc2)=C(N=Nc2ccc([N+](=O)[O-])cc2)S1,CC(C)=O,568.0
N#CC1=C(N)n2c(=O)c3ccccc3c(=O)n2C1c1ccc([N+](=O)[O-])cc1,CS(C)=O,355.0
N#CC1=C(N)n2c(=O)c3ccccc3c(=O)n2C1c1ccccc1,CS(C)=O,360.0
N#CC1=C(N)n2c(=O)c3ccccc3c(=O)n2C1c1cccs1,CS(C)=O,354.0
N#CC1=C(c2ccc(-c3cccs3)s2)CC1,C1CCOC1,366.0
N#CC1=C(c2ccc(-c3cccs3)s2)CC1,CC#N,364.0
N#CC1=C(c2ccc(-c3cccs3)s2)CC1,CCCCCC,361.0
N#CC1=C(c2ccc(-c3cccs3)s2)CC1,CCO,367.0
N#CC1=C(c2ccc(-c3cccs3)s2)CC1,OCCOCCO,371.0
N#CC1=C(c2ccc(-c3cccs3)s2)CC1,c1ccncc1,372.0
N#CC1=C(c2ccc(-c3cccs3)s2)CCC1,C1CCOC1,364.0
N#CC1=C(c2ccc(-c3cccs3)s2)CCC1,CC#N,362.0
N#CC1=C(c2ccc(-c3cccs3)s2)CCC1,CCCCCC,360.0
N#CC1=C(c2ccc(-c3cccs3)s2)CCC1,CCO,366.0
N#CC1=C(c2ccc(-c3cccs3)s2)CCC1,OCCOCCO,367.0
N#CC1=C(c2ccc(-c3cccs3)s2)CCC1,c1ccncc1,368.0
N#CC1=CC(C#Cc2ccccc2)=CC(C#N)=P1(c1ccccc1)c1ccccc1,ClC(Cl)Cl,489.0
N#CC1=CC(c2ccccc2)=CC(C#N)=P1(c1ccccc1)c1ccccc1,ClC(Cl)Cl,480.0
N#CC1=CC=CC(C#N)=P1(c1ccccc1)c1ccccc1,ClC(Cl)Cl,458.0
N#CC1=COC2=C(CCCC2)C1,CCO,383.0
N#CC1=c2c3cccc4cccc(c43)n2[B-](F)(F)[n+]2ccccc21,C1CCOC1,512.0
N#CC1=c2c3cccc4cccc(c43)n2[B-](F)(F)[n+]2ccccc21,CC#N,506.0
N#CC1=c2c3cccc4cccc(c43)n2[B-](F)(F)[n+]2ccccc21,CCCCCC,516.0
N#CC1=c2c3cccc4cccc(c43)n2[B-](F)(F)[n+]2ccccc21,Cc1ccccc1,517.0
N#CC1=c2c3cccc4cccc(c43)n2[B-](F)(F)[n+]2ccccc21,ClCCl,511.0
N#CC1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,CCO,682.0
N#CC1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,O,690.0
N#CC1CC(C(N)=O)N2N=CC=CC12,CCO,442.0
N#CC1CC(C(N)=O)N2N=Cc3ccccc3C12,CCO,439.0
N#CC1N=c2cc3c4c(cccc4c2=NC1C#N)C(c1ccccc1)=C(c1ccccc1)O3,ClCCl,501.0
N#CCC(=O)c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)s1,CN(C)C=O,412.0
N#CCc1ccccc1-c1cc2ccccc2oc1=O,ClC(Cl)Cl,318.0
N#CSC1=CC2=C(c3c(Cl)cccc3Cl)c3cc(SC#N)c(NCc4ccccc4)n3[B-](F)(F)[N+]2=C1NCc1ccccc1,CC#N,638.0
N#CSC1=CC2=C(c3c(Cl)cccc3Cl)c3cc(SC#N)c(NCc4ccccc4)n3[B-](F)(F)[N+]2=C1NCc1ccccc1,CCCCCC,644.0
N#CSC1=CC2=C(c3c(Cl)cccc3Cl)c3cc(SC#N)c(NCc4ccccc4)n3[B-](F)(F)[N+]2=C1NCc1ccccc1,CCOC(C)=O,641.0
N#CSC1=CC2=C(c3c(Cl)cccc3Cl)c3cc(SC#N)c(NCc4ccccc4)n3[B-](F)(F)[N+]2=C1NCc1ccccc1,CO,635.0
N#CSC1=CC2=C(c3c(Cl)cccc3Cl)c3cc(SC#N)c(NCc4ccccc4)n3[B-](F)(F)[N+]2=C1NCc1ccccc1,ClCCl,642.0
N#CSC1=CC2=C(c3ccccc3)c3cc(SC#N)c(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CC#N,588.0
N#CSC1=CC2=C(c3ccccc3)c3cc(SC#N)c(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CCCCCC,599.0
N#CSC1=CC2=C(c3ccccc3)c3cc(SC#N)c(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CCOC(C)=O,593.0
N#CSC1=CC2=C(c3ccccc3)c3cc(SC#N)c(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CO,585.0
N#CSC1=CC2=C(c3ccccc3)c3cc(SC#N)c(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,ClCCl,596.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CC#N,476.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CCCCCC,520.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CCOC(C)=O,487.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CO,477.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(N4CCOCC4)n3[B-](F)(F)[N+]2=C1N1CCOCC1,ClCCl,495.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(SC#N)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CCCCCC,560.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(SC#N)n3[B-](F)(F)[N+]2=C1N1CCOCC1,CCOC(C)=O,554.0
N#CSC1=CC2=C(c3ccccc3)c3ccc(SC#N)n3[B-](F)(F)[N+]2=C1N1CCOCC1,ClCCl,558.0
N#CSc1ccc2n1[B-](F)(F)[N+]1=C(N3CCOCC3)C=CC1=C2c1ccccc1,CC#N,452.0
N#CSc1ccc2n1[B-](F)(F)[N+]1=C(N3CCOCC3)C=CC1=C2c1ccccc1,CCCCCC,492.0
N#CSc1ccc2n1[B-](F)(F)[N+]1=C(N3CCOCC3)C=CC1=C2c1ccccc1,CCOC(C)=O,464.0
N#CSc1ccc2n1[B-](F)(F)[N+]1=C(N3CCOCC3)C=CC1=C2c1ccccc1,CO,458.0
N#CSc1ccc2n1[B-](F)(F)[N+]1=C(N3CCOCC3)C=CC1=C2c1ccccc1,ClCCl,468.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,C1CCCCC1,321.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,C1CCOC1,322.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,C1COCCO1,319.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,CC#N,321.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,CCCCCCC,319.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,CCO,323.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,CN(C)C=O,322.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,CO,322.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,O,324.0
N#C[Se]CCCCCOc1ccc2ccc(=O)oc2c1,OCCO,326.0
N#Cc1c(-c2cc3ccccc3o2)c(N)n2ccccc12,CN(C)C=O,373.0
N#Cc1c(-c2ccc(-c3ccccc3)cc2)c(N)n2ccccc12,CN(C)C=O,398.0
N#Cc1c(-c2ccc(Br)cc2)c(N)n2ccccc12,CN(C)C=O,398.0
N#Cc1c(-c2ccc(Br)cc2)cc(-c2ccc(Br)cc2)[nH]c1=O,C1CCOC1,377.0
N#Cc1c(-c2ccc(Br)cc2)cc(-c2ccc(Br)cc2)[nH]c1=O,CC#N,373.0
N#Cc1c(-c2ccc(Br)cc2)cc(-c2ccc(Br)cc2)[nH]c1=O,CCOC(C)=O,377.0
N#Cc1c(-c2ccc(Br)cc2)cc(-c2ccc(Br)cc2)[nH]c1=O,CN(C)C=O,388.0
N#Cc1c(-c2ccc(Br)cc2)cc(-c2ccc(Br)cc2)[nH]c1=O,CO,368.0
N#Cc1c(-c2ccc(Br)cc2)cc(-c2ccc(Br)cc2)[nH]c1=O,CS(C)=O,391.0
N#Cc1c(-c2ccc(Br)cc2)cc(-c2ccc(Br)cc2)[nH]c1=O,ClC(Cl)Cl,371.0
N#Cc1c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(C#N)c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)c(C#N)c1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,O=P(c1ccccc1)(c1ccccc1)c1ccccc1Oc1ccccc1P(=O)(c1ccccc1)c1ccccc1,420.0
N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O,C1CCOC1,395.0
N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O,CC#N,390.0
N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O,CCOC(C)=O,391.0
N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O,CN(C)C=O,437.0
N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O,CO,392.0
N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O,CS(C)=O,448.0
N#Cc1c(-c2ccc([N+](=O)[O-])cc2)cc(-c2ccc([N+](=O)[O-])cc2)[nH]c1=O,ClC(Cl)Cl,386.0
N#Cc1c(-c2ccc3c(c2)Cc2ccccc2-3)c(N)n2ccccc12,CN(C)C=O,398.0
N#Cc1c(-c2ccc3ccccc3c2)c(N)n2ccccc12,CN(C)C=O,398.0
N#Cc1c(-c2cccc3ccccc23)c(N)n2ccccc12,CN(C)C=O,397.0
N#Cc1c(-c2ccccc2)c(N)n2ccccc12,CN(C)C=O,398.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,C1COCCO1,446.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,CC#N,434.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,CCCCO,441.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,CCCO,431.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,CCO,407.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,CCOC(C)=O,430.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,CCOCC,451.0
N#Cc1c(-c2ccccc2)cc(-c2ccccc2)[nH]c1=S,CN(C)C=O,439.0
N#Cc1c(-c2ccccc2)cc(N2c3ccccc3Oc3ccccc32)cc1-c1ccccc1,C1CCCCC1,398.0
N#Cc1c(-c2ccccc2F)c(N)n2ccccc12,CN(C)C=O,383.0
N#Cc1c(-c2ccccc2O)c(N)n2ccccc12,CN(C)C=O,392.0
N#Cc1c(-c2cccs2)cc(-c2ccc3c(c2)Cc2ccccc2-3)[nH]c1=O,C1CCOC1,343.0
N#Cc1c(-c2cccs2)cc(-c2ccc3c(c2)Cc2ccccc2-3)[nH]c1=O,CC#N,389.0
N#Cc1c(-c2cccs2)cc(-c2ccc3c(c2)Cc2ccccc2-3)[nH]c1=O,CCOC(C)=O,394.0
N#Cc1c(-c2cccs2)cc(-c2ccc3c(c2)Cc2ccccc2-3)[nH]c1=O,CN(C)C=O,440.0
N#Cc1c(-c2cccs2)cc(-c2ccc3c(c2)Cc2ccccc2-3)[nH]c1=O,CO,394.0
N#Cc1c(-c2cccs2)cc(-c2ccc3c(c2)Cc2ccccc2-3)[nH]c1=O,CS(C)=O,449.0
N#Cc1c(-c2cccs2)cc(-c2ccc3c(c2)Cc2ccccc2-3)[nH]c1=O,ClC(Cl)Cl,385.0
N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O,C1CCOC1,404.0
N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O,CC#N,397.0
N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O,CCOC(C)=O,401.0
N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O,CN(C)C=O,407.0
N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O,CO,390.0
N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O,CS(C)=O,414.0
N#Cc1c(-c2cccs2)cc(-c2cccs2)[nH]c1=O,ClC(Cl)Cl,397.0
N#Cc1c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c(C#N)c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c1-n1c2ccc(Br)cc2c2cc(Br)ccc21,Cc1ccccc1,339.0
N#Cc1c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c(C#N)c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c(-n2c3ccc(Br)cc3c3cc(Br)ccc32)c1-n1c2ccc(Br)cc2c2cc(Br)ccc21,Cc1ccccc1,374.0
N#Cc1c(-n2c3ccccc3c3cc(Br)ccc32)c(-n2c3ccccc3c3cc(Br)ccc32)c(C#N)c(-n2c3ccccc3c3cc(Br)ccc32)c1-n1c2ccccc2c2cc(Br)ccc21,Cc1ccccc1,337.0
N#Cc1c(-n2c3ccccc3c3cc(Br)ccc32)c(C#N)c(-n2c3ccccc3c3cc(Br)ccc32)c(-n2c3ccccc3c3cc(Br)ccc32)c1-n1c2ccccc2c2cc(Br)ccc21,Cc1ccccc1,381.0
N#Cc1c(-n2c3ccccc3c3cc(I)ccc32)c(-n2c3ccccc3c3cc(I)ccc32)c(C#N)c(-n2c3ccccc3c3cc(I)ccc32)c1-n1c2ccccc2c2cc(I)ccc21,Cc1ccccc1,348.0
N#Cc1c(-n2c3ccccc3c3cc(I)ccc32)c(C#N)c(-n2c3ccccc3c3cc(I)ccc32)c(-n2c3ccccc3c3cc(I)ccc32)c1-n1c2ccccc2c2cc(I)ccc21,Cc1ccccc1,383.0
N#Cc1c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21,Cc1ccccc1,402.99
N#Cc1c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21,Cc1ccccc1,394.95
N#Cc1c(-n2c3ccccc3c3ccccc32)c(C#N)c(-n2c3ccccc3c3ccccc32)c(-n2c3ccccc3c3ccccc32)c1-n1c2ccccc2c2ccccc21,Cc1ccccc1,375.0
N#Cc1c(-n2c3ccccc3c3ccccc32)cccc1-n1c2ccccc2c2ccccc21,Cc1ccccc1,355.0
N#Cc1c(-n2cc(-c3ccccc3)nn2)n([C@H]2C[C@H](O)[C@@H](CO)O2)c2ncnc(N)c12,CO,295.0
N#Cc1c(-n2nnc3c2-c2ccccc2CN(C(=O)CCN)c2ccccc2-3)n([C@H]2C[C@H](O)[C@@H](CO)O2)c2ncnc(N)c12,CO,290.0
N#Cc1c(-n2nnc3c2CCC2C(CC3)[C@@H]2CO)n([C@H]2C[C@H](O)[C@@H](CO)O2)c2ncnc(N)c12,CO,287.0
N#Cc1c(-n2nnc3cc(Cl)ccc32)n([C@H]2C[C@H](O)[C@@H](CO)O2)c2ncnc(N)c12,CO,276.0
N#Cc1c(-n2nnc3ccccc32)n([C@H]2C[C@H](O)[C@@H](CO)O2)c2ncnc(N)c12,CO,278.0
N#Cc1c(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc(-c2cccs2)cc1N1CCCCC1,CS(C)=O,404.0
N#Cc1c(C#Cc2ccccc2)c(N)n2ccccc12,CN(C)C=O,348.0
N#Cc1c(C#N)c2cc(Br)ccc2c2ccc(Br)cc12,ClC(Cl)Cl,350.0
N#Cc1c(C#N)c2cc(Cl)c(Cl)cc2c2cc(Cl)c(Cl)cc12,ClC(Cl)Cl,343.0
N#Cc1c(C#N)c2cc(Cl)ccc2c2ccc(Cl)cc12,ClC(Cl)Cl,347.0
N#Cc1c(C#N)c2cc(F)ccc2c2ccc(F)cc12,ClC(Cl)Cl,335.0
N#Cc1c(C#N)c2ccc3ccc4ccccc4c3c2c2c1ccc1ccc3ccccc3c12,ClCCl,268.0
N#Cc1c(C#N)c2ccccc2c2ccccc12,ClC(Cl)Cl,346.0
N#Cc1c(N)nc(N)c(C#N)c1-c1c(F)cccc1Cl,C1CCOC1,343.0
N#Cc1c(N)nc(N)c(C#N)c1-c1ccc(Cl)cc1,C1CCOC1,339.0
N#Cc1c(N)nc(N)c(C#N)c1-c1ccc(Cl)cc1Cl,C1CCOC1,332.0
N#Cc1c(N)nc(N)c(C#N)c1-c1ccc(O)cc1,C1CCOC1,338.0
N#Cc1c(N)nc(N)c(C#N)c1-c1cccc2ccccc12,C1CCOC1,337.0
N#Cc1c(N)nc(N)c(C#N)c1-c1ccccc1,C1CCOC1,341.0
N#Cc1c(N)nc(N)c(C#N)c1-c1ccccc1Cl,C1CCOC1,339.0
N#Cc1c(N)nc(N)c(C#N)c1-c1ccccc1F,C1CCOC1,338.0
N#Cc1c(N)nc(N)c(C#N)c1-c1ccccc1O,C1CCOC1,374.0
N#Cc1c(N)sc(N=Nc2ccc([N+](=O)[O-])cc2)c1-c1ccc(Cl)cc1,CC(C)=O,562.0
N#Cc1c(N)sc2c1-c1ccccc1C2=Nc1ccc([N+](=O)[O-])cc1,CC(C)=O,464.0
N#Cc1c(N)sc2c1-c1ccccc1C2=Nc1ccccc1,CC(C)=O,445.0
N#Cc1c(N2CCCC2)cc(-c2ccccc2)c2c1-c1cccc3cccc-2c13,O,428.0
N#Cc1c(N2CCCC2)cc(-c2ccccc2)c2c1-c1ccccc1C2=O,C1CCOC1,392.0
N#Cc1c(N2CCCC2)cc(-c2ccccc2)c2c1C(=O)c1ccccc1-2,C1CCOC1,358.0
N#Cc1c(N2CCCC2)cc(-c2ccccc2)c2c1Cc1ccccc1-2,C1CCOC1,382.0
N#Cc1c(N2CCCCC2)cc(-c2ccc(-c3ccccc3)cc2)c2c1CCc1ccccc1-2,C1CCOC1,332.0
N#Cc1c(N2CCCCC2)cc(-c2ccc(-c3ccccc3)s2)c2c1CCc1ccccc1-2,C1CCOC1,345.0
N#Cc1c(N2CCCCC2)cc(-c2ccc(Br)cc2)c2c1CCc1ccccc1-2,C1CCOC1,356.0
N#Cc1c(N2CCCCC2)cc(-c2ccc(O)cc2)c2c1-c1cccc3cccc-2c13,O,432.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3c(c2)OCO3)c2c1-c1cccc3cccc-2c13,O,429.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3ccc4cccc5ccc2c3c45)c2c1-c1ccccc1C2,C1CCOC1,346.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3ccc4cccc5ccc2c3c45)c2c1C(=O)c1ccccc1-2,C1CCOC1,344.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3ccc4cccc5ccc2c3c45)c2c1Cc1ccccc1-2,C1CCOC1,344.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3ccccc3c2)c2c1-c1ccccc1C2,C1CCOC1,362.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3ccccc3c2)c2c1-c1ccccc1C2=O,C1CCOC1,392.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3ccccc3c2)c2c1C(=O)c1ccccc1-2,C1CCOC1,346.0
N#Cc1c(N2CCCCC2)cc(-c2ccc3ccccc3c2)c2c1Cc1ccccc1-2,C1CCOC1,362.0
N#Cc1c(N2CCCCC2)cc(-c2cccc3ccccc23)c2c1-c1ccccc1C2,C1CCOC1,358.0
N#Cc1c(N2CCCCC2)cc(-c2cccc3ccccc23)c2c1-c1ccccc1C2=O,C1CCOC1,390.0
N#Cc1c(N2CCCCC2)cc(-c2cccc3ccccc23)c2c1C(=O)c1ccccc1-2,C1CCOC1,344.0
N#Cc1c(N2CCCCC2)cc(-c2cccc3ccccc23)c2c1Cc1ccccc1-2,C1CCOC1,358.0
N#Cc1c(N2CCCCC2)cc(-c2ccccc2)c2c1-c1ccccc1C2,C1CCOC1,360.0
N#Cc1c(N2CCCCC2)cc(-c2ccccc2)c2c1C(=O)c1ccccc1-2,C1CCOC1,348.0
N#Cc1c(N2CCCCC2)cc(-c2ccccc2)c2c1Cc1ccccc1-2,C1CCOC1,358.0
N#Cc1c(N2CCCCC2)cc(-c2cccs2)c2c1CCc1ccccc1-2,C1CCOC1,330.0
N#Cc1c(N2c3ccccc3C(c3ccccc3)(c3ccccc3)c3ccccc32)cccc1N1c2ccccc2C(c2ccccc2)(c2ccccc2)c2ccccc21,Cc1ccccc1,369.0
N#Cc1c2c3c(oc(=O)c2c(=N)n2[nH]c(-c4ccc(F)cc4)cc12)-c1ccccc1SC3,CN(C)C=O,441.0
N#Cc1c2c3c(oc(=O)c2c(=N)n2[nH]c(-c4ccccc4)cc12)-c1ccccc1CC3,CN(C)C=O,428.0
N#Cc1c2nc3ccccn3c2nc2c1nc1ccccn12,C1CCCCC1,410.0
N#Cc1c2nc3ccccn3c2nc2c1nc1ccccn12,C1COCCO1,425.0
N#Cc1c2nc3ccccn3c2nc2c1nc1ccccn12,CC#N,430.0
N#Cc1c2nc3ccccn3c2nc2c1nc1ccccn12,CN(C)C=O,435.0
N#Cc1c2nc3ccccn3c2nc2c1nc1ccccn12,ClC(Cl)Cl,425.0
N#Cc1c2nc3ccccn3c2nc2nc3ccccn3c12,C1CCCCC1,455.0
N#Cc1c2nc3ccccn3c2nc2nc3ccccn3c12,C1COCCO1,460.0
N#Cc1c2nc3ccccn3c2nc2nc3ccccn3c12,CC#N,480.0
N#Cc1c2nc3ccccn3c2nc2nc3ccccn3c12,CN(C)C=O,490.0
N#Cc1c2nc3ccccn3c2nc2nc3ccccn3c12,ClC(Cl)Cl,475.0
N#Cc1c2oc3ccccc3oc2c(C#N)c2oc3ccccc3oc12,ClC(Cl)Cl,430.0
N#Cc1c[nH]c2ccccc12,C1COCCO1,277.3006135
N#Cc1c[nH]c2ccccc12,CC#N,276.25
N#Cc1cc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)ccc1O,ClCCl,376.0
N#Cc1cc(-c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)c2)ccc1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,428.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,C1COCCO1,356.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,CC#N,355.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,CC(C)O,354.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,CCO,352.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,CO,350.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,CS(C)=O,362.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,ClC(Cl)(Cl)Cl,350.0
N#Cc1cc(-c2ccc(F)cc2)cnc1O,O,343.0
N#Cc1cc(-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)c(-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)cc1C#N,Cc1ccccc1,406.0
N#Cc1cc(-c2ccccc2)c(N2c3ccccc3Oc3ccccc32)c(-c2ccccc2)c1,C1CCCCC1,405.0
N#Cc1cc(-n2c3ccccc3c3cccnc32)c(-n2c3ccccc3c3cccnc32)cc1C#N,Cc1ccccc1,338.0794702
N#Cc1cc(-n2c3ccccc3c3ncccc32)c(-n2c3ccccc3c3ncccc32)cc1C#N,Cc1ccccc1,364.8484848
N#Cc1cc(/C=C/c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)c2)ccc1/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClCCl,429.0
N#Cc1cc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)ccc1-c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1C#N,ClCCl,386.0
N#Cc1cc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)ccc1/C=C/c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,433.0
N#Cc1cc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)ccc1/C=C/c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1C#N,ClCCl,447.0
N#Cc1cc(C#Cc2c(F)c(F)nc(F)c2F)c(C#Cc2c(F)c(F)nc(F)c2F)cc1C#N,CC#N,315.0
N#Cc1cc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c(C#N)cc1C#Cc1ccccc1,ClC(Cl)Cl,452.0
N#Cc1cc(C#N)c(-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)cc1-c1cc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)c1,Cc1ccccc1,337.0
N#Cc1cc(C#N)c(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,394.0
N#Cc1cc(N)cc(C#N)c1,CC#N,340.0
N#Cc1cc(N)cc(C#N)c1,CCCCCCC,325.0
N#Cc1cc(N)cc(C#N)c1,CCO,346.0
N#Cc1cc(N)cc(C#N)c1,O,330.0
N#Cc1cc(N2c3ccccc3Oc3ccccc32)c(N2c3ccccc3Oc3ccccc32)cc1C#N,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,540.0
N#Cc1cc(N2c3ccccc3Oc3ccccc32)cc(N2c3ccccc3Oc3ccccc32)c1,Cc1ccccc1,340.0
N#Cc1cc(N2c3ccccc3Sc3ccccc32)c(N2c3ccccc3Sc3ccccc32)cc1C#N,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,551.0
N#Cc1cc(N2c3ccccc3Sc3ccccc32)cc(N2c3ccccc3Sc3ccccc32)c1,Cc1ccccc1,343.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,C1CCCCC1,332.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,C1CCOC1,337.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,CC(C)=O,429.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,CCCCCC,331.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,CCOC(C)=O,334.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,CN(C)C=O,439.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,CS(C)=O,444.0
N#Cc1cc([N+](=O)[O-])ccc1/C=C/c1ccc(-c2cc3ccccc3s2)s1,Cc1ccccc1,337.0
N#Cc1cc2c(-c3ccccc3)c(-c3ccccc3)c3cccc4c(-c5ccccc5)c(-c5ccccc5)c(c1)[n+]2c34,ClCCl,365.0
N#Cc1cc2c3c(c1)c(=O)c(=O)c1cc(C#N)cc(c1-3)c(=O)c2=O,CN(C)C=O,290.0
N#Cc1cc2ccc(O)cc2oc1=O,C1CCCCC1,361.0
N#Cc1cc2ccc(O)cc2oc1=O,C1CCOC1,355.0
N#Cc1cc2ccc(O)cc2oc1=O,CC#N,352.0
N#Cc1cc2ccc(O)cc2oc1=O,CCOC(C)=O,356.0
N#Cc1cc2ccc(O)cc2oc1=O,CS(C)=O,351.0
N#Cc1cc2ccc(O)cc2oc1=O,ClC(Cl)Cl,359.0
N#Cc1cc2ccc(O)cc2oc1=O,O,355.0
N#Cc1cc2ccc([O-])cc2oc1=O,O,408.0
N#Cc1cc2ccc(cc2)c2cccc3cccc(c4ccc(cc4)cc(C#N)c4ccc(cc4)c4cccc5cccc(c6ccc1cc6)c54)c32,Cc1ccccc1,350.0
N#Cc1cc2ccc3cc(C#N)c4ccccc4c3c2c2ccccc12,ClC(Cl)Cl,422.0
N#Cc1cc2ccccc2c2ccccc12,CCOC(C)=O,489.0
N#Cc1cc2ccccc2oc1=N,C1CCOC1,350.0
N#Cc1cc2ccccc2oc1=N,CC#N,348.0
N#Cc1cc2ccccc2oc1=N,CCOC(C)=O,351.0
N#Cc1cc2ccccc2oc1=N,CS(C)=O,347.0
N#Cc1cc2ccccc2oc1=N,ClC(Cl)Cl,352.0
N#Cc1cc2ccccc2oc1=O,C1CCCCC1,342.0
N#Cc1cc2ccccc2oc1=O,C1CCOC1,338.0
N#Cc1cc2ccccc2oc1=O,CC#N,336.0
N#Cc1cc2ccccc2oc1=O,CCOC(C)=O,339.0
N#Cc1cc2ccccc2oc1=O,CS(C)=O,334.0
N#Cc1cc2ccccc2oc1=O,ClC(Cl)Cl,340.0
N#Cc1cc2nc3c(nc2cc1C#N)C1c2ccc(N(c4ccccc4)c4ccccc4)cc2C3c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,428.0
N#Cc1cc2nc3c(nc2cc1C#N)C1c2ccc(N(c4ccccc4)c4ccccc4)cc2C3c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,410.0
N#Cc1cc2nc3c(nc2cc1C#N)C1c2ccc(N(c4ccccc4)c4ccccc4)cc2C3c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,420.0
N#Cc1cc2nc3c(nc2cc1C#N)C1c2ccc(N(c4ccccc4)c4ccccc4)cc2C3c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,428.0
N#Cc1ccc(-c2cc(-c3ccc(N4CCCC4)cc3)nc(-c3ccccc3)n2)cc1,ClC(Cl)Cl,385.0
N#Cc1ccc(-c2cc3c(ccc4sccc43)s2)cc1,ClCCl,346.0
N#Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,C1CCOC1,367.0
N#Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,CC#N,366.0
N#Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,CCCCCC,366.0
N#Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,CCO,369.5
N#Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,OCCOCCO,372.0
N#Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,c1ccncc1,373.0
N#Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,C1CCOC1,366.0
N#Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,CC#N,366.0
N#Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,CCCCCC,366.0
N#Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,CCO,366.0
N#Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,OCCOCCO,366.0
N#Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,c1ccncc1,369.0
N#Cc1ccc(-c2ccc(F)cc2)nc1,ClC(Cl)Cl,329.0
N#Cc1ccc(-c2ccc(N(c3ccc(C#Cc4cc(C#N)c(C#Cc5cc(C#N)ccc5C#N)cc4C#N)cc3)c3ccc(-c4ccc(C#N)cc4)cc3)cc2)cc1,ClC(Cl)Cl,473.0
N#Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4)ccc2c2c3nc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)n2-c2ccccc2)cc1,C1CCOC1,360.4395604
N#Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4)ccc2c2c3nc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)n2-c2ccccc2)cc1,CC#N,360.4395604
N#Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4)ccc2c2c3nc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)n2-c2ccccc2)cc1,CCCCCC,370.0549451
N#Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C#N)cc4)ccc2c2c3nc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)n2-c2ccccc2)cc1,CCOCC,366.2087912
N#Cc1ccc(-c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,343.0
N#Cc1ccc(-c2ccnc3nc(-c4ccc(N5CCCCC5)cc4)nn23)cc1,ClCCl,391.0
N#Cc1ccc(-c2ccnc3ncnn23)cc1,ClCCl,300.0
N#Cc1ccc(-c2cn3cc(-c4ccccc4)c[n+]3[n-]2)cc1,ClCCl,383.0
N#Cc1ccc(-c2cn3cc(C#N)c[n+]3[n-]2)cc1,ClCCl,360.0
N#Cc1ccc(-c2cn3ccc[n+]3[n-]2)cc1,ClCCl,381.0
N#Cc1ccc(-c2cnc3cccc(-c4ccccc4)n23)cc1,ClCCl,331.0
N#Cc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1,CO,339.0
N#Cc1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,C1CCCCC1,377.0
N#Cc1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,CO,372.0
N#Cc1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,ClCCl,380.0
N#Cc1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,O,430.0
N#Cc1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1,ClC(Cl)Cl,399.0
N#Cc1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClC(Cl)Cl,326.0
N#Cc1ccc(-c2nc3c4ccccc4c4cccc2n43)cc1,CO,469.0
N#Cc1ccc(-c2nc3nccc(-c4ccc(N5CCCCC5)cc4)n3n2)cc1,ClCCl,400.0
N#Cc1ccc(-c2nc3ncccn3n2)cc1,ClCCl,296.0
N#Cc1ccc(-c2ncc3cccc(-c4ccccc4)n23)cc1,ClCCl,331.0
N#Cc1ccc(-c2nnc3ccccn23)cc1,ClCCl,309.0
N#Cc1ccc(-c2pc3ccccc3s2)cc1,CC#N,340.0
N#Cc1ccc(-n2c(-c3ccc(-c4ccc(-c5nc6c7ccccc7c7ccccc7c6n5-c5ccc(C#N)c6ccccc56)c5ccccc45)c4ccccc34)nc3c4ccccc4c4ccccc4c32)c2ccccc12,ClCCl,336.0
N#Cc1ccc(-n2c(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)s3)nc3c4ccccc4c4ccccc4c32)c2ccccc12,ClCCl,301.0
N#Cc1ccc(-n2c(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)nc3c4ccccc4c4ccccc4c32)c2ccccc12,ClCCl,308.0
N#Cc1ccc(-n2c3ccccc3c3c2c2ccccc2n3-c2ccccc2)cc1,Cc1ccccc1,359.0
N#Cc1ccc(-n2c3ccccc3c3cc(/C=C/C(=O)O)ccc32)cc1,CC#N,379.0
N#Cc1ccc(-n2nc(C#N)c(N3CCCC3)n2)cc1,CC#N,362.0
N#Cc1ccc(-n2ncc(-c3ccc(Cl)cc3)n2)cc1,CO,306.0
N#Cc1ccc(/C2=C3/N=C(C(c4ccccc4)=C3c3ccccc3)/C(c3ccc(C#N)cc3)=c3\[nH]/c(c(-c4ccccc4)c3-c3ccccc3)=C(/c3ccc(C#N)cc3)C3=N/C(=C(/c4ccc(C#N)cc4)c4[nH]c2c(-c2ccccc2)c4-c2ccccc2)C(c2ccccc2)=C3c2ccccc2)cc1,ClCCl,704.0
N#Cc1ccc(/C=C/C(F)(F)F)c(N)c1,C1CCOC1,367.0
N#Cc1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,C1COCCO1,395.0
N#Cc1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,CC#N,387.0
N#Cc1ccc(/C=C/C=C/C2=NC3C(=O)NC(N)=NC3N2[C@H]2C[C@H](O)[C@@H](CO)O2)cc1,CO,381.0
N#Cc1ccc(/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C1CCOC1,378.0
N#Cc1ccc(/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,C1COCCO1,368.0
N#Cc1ccc(/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CC#N,374.0
N#Cc1ccc(/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CCCCCCC,362.0
N#Cc1ccc(/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CN(C)C=O,381.0
N#Cc1ccc(/C=C/C=C/c2ccc([N+](=O)[O-])cc2)cc1,CO,375.0
N#Cc1ccc(/C=C/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,375.0
N#Cc1ccc(/C=C/C=C/c2ccccc2)cc1,C1CCOC1,346.0
N#Cc1ccc(/C=C/C=C/c2ccccc2)cc1,C1COCCO1,347.0
N#Cc1ccc(/C=C/C=C/c2ccccc2)cc1,CC#N,344.0
N#Cc1ccc(/C=C/C=C/c2ccccc2)cc1,CCCCCCC,344.0
N#Cc1ccc(/C=C/C=C/c2ccccc2)cc1,CN(C)C=O,349.0
N#Cc1ccc(/C=C/C=C/c2ccccc2)cc1,CO,344.0
N#Cc1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,370.0
N#Cc1ccc(/C=C/c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,366.0
N#Cc1ccc(/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,358.0
N#Cc1ccc(/C=C2\C=C(c3ccccc3)NC2=O)cc1,C1COCCO1,438.0
N#Cc1ccc(/C=C2\N=C(c3ccccc3)NC2=O)cc1,C1COCCO1,393.0
N#Cc1ccc(/C=C2\N=C(c3ccccc3)OC2=O)cc1,C1COCCO1,369.0
N#Cc1ccc(/C=c2\o/c(=C\c3ccc(N4CCCCC4)cc3)c3ccccc23)cc1,ClCCl,431.0
N#Cc1ccc(/N=N/c2cc3c4c(c2)CCCN4CCC3)cc1,CCOC(C)=O,487.0
N#Cc1ccc(C#Cc2ccc(C#Cc3ccccc3C#N)cc2C#N)cc1,ClC(Cl)Cl,340.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,C1COCCO1,408.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,CC(C)=O,405.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,CCCCCC,412.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,CCCCCCO,410.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,CCO,407.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,CCOC(C)=O,406.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,CO,405.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,Cc1ccccc1,414.0
N#Cc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(C#N)cc5)c5ccc2c3c45)cc1,ClCCl,412.0
N#Cc1ccc(C#Cc2ccccc2C#N)cc1,ClC(Cl)Cl,297.0
N#Cc1ccc(C#Cc2ncc(-c3ccccc3)o2)cc1,ClCCl,345.0
N#Cc1ccc(C#N)c(C#Cc2cc(C#N)c(C#Cc3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2C#N)c1,ClC(Cl)Cl,491.0
N#Cc1ccc(C#N)c(C#Cc2cc(C#N)c(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2C#N)c1,ClC(Cl)Cl,479.0
N#Cc1ccc(C#N)c(C#Cc2ccc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)c(C#N)c2)c1,ClC(Cl)Cl,432.0
N#Cc1ccc(C#N)c(N)c1,CC#N,352.0
N#Cc1ccc(C#N)c(N)c1,CCCCCCC,335.0
N#Cc1ccc(C#N)c(N)c1,CCO,358.0
N#Cc1ccc(C#N)c(N)c1,O,349.0
N#Cc1ccc(C2=C3C=CC(n4cccn4)=[N+]3[B-](F)(F)n3c2ccc3-n2cccn2)cc1,ClCCl,568.0
N#Cc1ccc(C2=C3C=CC(n4cnc5ccccc54)=[N+]3[B-](F)(F)n3c2ccc3-n2cnc3ccccc32)cc1,ClCCl,561.0
N#Cc1ccc(C2=Cc3ccccc3P2(=O)c2ccccc2)cc1,ClCCl,350.0
N#Cc1ccc(C=C(c2ccccc2)c2ccccc2)cc1,C1CCOC1,321.0
N#Cc1ccc(C[C@H](N)C(=O)O)cc1,C1CCOC1,236.8079946
N#Cc1ccc(C[C@H](N)C(=O)O)cc1,CCO,233.5828443
N#Cc1ccc(C[C@H](N)C(=O)O)cc1,O,233.3347559
N#Cc1ccc(N(c2ccc(C#N)cc2)c2ccc(C#Cc3cc(C#N)c(C#Cc4cc(C#N)ccc4C#N)cc3C#N)cc2)cc1,ClC(Cl)Cl,426.0
N#Cc1ccc(N(c2ccc(C#N)cc2)c2ccc3c4cccc5c(N(c6ccc(C#N)cc6)c6ccc(C#N)cc6)ccc(c6cccc2c63)c54)cc1,C1CCCCC1,446.0
N#Cc1ccc(N(c2ccc(C#N)cc2)c2ccc3c4cccc5c(N(c6ccc(C#N)cc6)c6ccc(C#N)cc6)ccc(c6cccc2c63)c54)cc1,C1CCOC1,452.0
N#Cc1ccc(N(c2ccc(C#N)cc2)c2ccc3c4cccc5c(N(c6ccc(C#N)cc6)c6ccc(C#N)cc6)ccc(c6cccc2c63)c54)cc1,CC#N,446.0
N#Cc1ccc(N(c2ccc(C#N)cc2)c2ccc3c4cccc5c(N(c6ccc(C#N)cc6)c6ccc(C#N)cc6)ccc(c6cccc2c63)c54)cc1,Cc1ccccc1,451.0
N#Cc1ccc(N(c2ccc(C#N)cc2)c2ccc3c4cccc5c(N(c6ccc(C#N)cc6)c6ccc(C#N)cc6)ccc(c6cccc2c63)c54)cc1,ClCCl,450.0
N#Cc1ccc(N(c2ccccc2)c2ccc3ccc4c(N(c5ccccc5)c5ccc(C#N)cc5)ccc5ccc2c3c54)cc1,ClCCl,407.0
N#Cc1ccc(N)c(/C=C/C(F)(F)F)c1,C1CCOC1,348.0
N#Cc1ccc(N)c(C#N)c1,CC#N,326.0
N#Cc1ccc(N)c(C#N)c1,CCCCCCC,325.0
N#Cc1ccc(N)c(C#N)c1,CCO,347.0
N#Cc1ccc(N)c(C#N)c1,O,325.0
N#Cc1ccc(N)cc1C#N,CC#N,328.0
N#Cc1ccc(N)cc1C#N,CCCCCCC,316.0
N#Cc1ccc(N)cc1C#N,CCO,335.0
N#Cc1ccc(N)cc1C#N,O,326.0
N#Cc1ccc(N/N=C/c2cc(Cl)ccc2O)cc1,CO,354.0
N#Cc1ccc(N/N=C/c2cc([N+](=O)[O-])ccc2O)cc1,CO,336.0
N#Cc1ccc(N/N=C/c2ccc3ccccc3c2O)cc1,CC#N,380.0
N#Cc1ccc(N/N=C/c2ccc3ccccc3c2O)cc1,CCCCCC,384.0
N#Cc1ccc(N/N=C/c2ccc3ccccc3c2O)cc1,CO,380.0
N#Cc1ccc(N/N=C/c2ccc3ccccc3c2O)cc1,CS(C)=O,390.0
N#Cc1ccc(N/N=C/c2ccc3ccccc3c2O)cc1,ClC(Cl)Cl,384.0
N#Cc1ccc(N2c3c(sc4ccccc34)Sc3sc4ccccc4c32)cc1,ClCCl,309.0
N#Cc1ccc(N2c3ccccc3C(c3ccccc3)(c3ccccc3)c3ccccc32)cc1,Cc1ccccc1,352.0
N#Cc1ccc(N=Nc2ccc(N)cc2N)cc1,CN1CCCC1=O,262.0
N#Cc1ccc(O)c(O)c1,C1CCOC1,290.0
N#Cc1ccc(Oc2ccc3c4c(cccc24)C(=O)N(CCO)C3=O)cc1,ClC(Cl)Cl,352.0
N#Cc1ccc([N+]2=Cc3cccn3[B-]2(c2ccccc2)c2ccccc2)cc1,C1CCOC1,403.9087947882736
N#Cc1ccc2[nH]ccc2c1,C1COCCO1,274.8466258
N#Cc1ccc2[nH]ccc2c1,CC#N,275.0
N#Cc1ccc2[nH]ccc2c1,O,275.0
N#Cc1ccc2c(c1)C1(c3cc(C#N)ccc3-2)c2ccccc2N(c2ccccc2)c2ccccc21,Cc1ccccc1,330.3287982
N#Cc1ccc2c(c1)c1cccc3cnc2n31,CO,450.0
N#Cc1ccc2c(c1)c1ccccc1n1c3ccccc3nc21,CC#N,320.0
N#Cc1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CC#N,345.0
N#Cc1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CCO,345.0
N#Cc1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CCOC(C)=O,345.0
N#Cc1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,CO,345.0
N#Cc1ccc2cc(C#Cc3cn([C@H]4C[C@H](O)[C@@H](CO)O4)c4ncnc(N)c34)ccc2c1,ClC(Cl)Cl,345.0
N#Cc1ccc2cc[nH]c2c1,C1COCCO1,284.3558282
N#Cc1ccc2cc[nH]c2c1,CC#N,285.0
N#Cc1ccc2cc[nH]c2c1,O,285.0
N#Cc1ccc2nc3[nH]c(=O)[nH]c(=O)c3nc2c1,ClCCCl,387.0
N#Cc1ccc2nc3c(=O)[nH]c(=O)[nH]c3nc2c1,ClCCCl,398.0
N#Cc1cccc(-c2cccc(-c3nc(-c4cccc(-c5cccc(C#N)c5)c4)nc(-c4cccc(-c5cccc(C#N)c5)c4)n3)c2)c1,ClCCl,270.0
N#Cc1cccc(-c2cn3ccc[n+]3[n-]2)c1,ClCCl,327.0
N#Cc1cccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c1,CO,308.0
N#Cc1cccc(-c2pc3ccccc3s2)c1,CC#N,324.0
N#Cc1cccc(C#N)c1N,CC#N,343.0
N#Cc1cccc(C#N)c1N,CCCCCCC,332.0
N#Cc1cccc(C#N)c1N,CCO,347.0
N#Cc1cccc(C#N)c1N,O,344.0
N#Cc1cccc(N)c1,C1CCCCC1,310.0
N#Cc1cccc(N)c1,CC#N,319.0505173
N#Cc1cccc(N)c1,CCCCCC,309.1905052
N#Cc1cccc(N)c1,CCO,321.0
N#Cc1cccc(N)c1,O,307.0
N#Cc1cccc(N)c1,OCC(F)(F)F,300.0
N#Cc1cccc(N2c3ccccc3C(c3ccccc3)(c3ccccc3)c3ccccc32)c1,Cc1ccccc1,284.0
N#Cc1cccc2[nH]ccc12,C1COCCO1,304.2944785
N#Cc1cccc2[nH]ccc12,CC#N,302.8125
N#Cc1cccc2[nH]ccc12,O,305.0
N#Cc1cccc2cc[nH]c12,C1COCCO1,307.3619632
N#Cc1cccc2cc[nH]c12,CC#N,309.6875
N#Cc1cccc2cc[nH]c12,O,308.0
N#Cc1ccccc1-c1c(C#N)c(N)nc(N)c1C#N,C1CCOC1,493.0
N#Cc1ccccc1-c1cn2ccc[n+]2[n-]1,ClCCl,376.0
N#Cc1ccccc1C#Cc1ccc(C#Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)c(C#N)c1,ClC(Cl)Cl,420.0
N#Cc1ccccc1N,C1CCCCC1,314.0
N#Cc1ccccc1N,CC#N,321.0
N#Cc1ccccc1N,CCO,325.0
N#Cc1ccccc1N,O,315.0
N#Cc1ccccc1N,OCC(F)(F)F,314.0
N#Cc1ccccc1N1c2ccccc2C(c2ccccc2)(c2ccccc2)c2ccccc21,Cc1ccccc1,356.0
N#Cc1ccccc1N1c2sc3ccccc3c2Sc2c1sc1ccccc21,ClCCl,411.0
N#Cc1ccn2c(N)c(-c3ccc(Cl)cc3)nc2c1,CS(C)=O,430.0
N#Cc1cnc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)nc1,CCO,390.0
N#Cc1cnc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)nc1,ClCCl,394.0
N#Cc1cnc(-c2c3ccccc3c(-c3ncc(C#N)cn3)c3ccccc23)nc1,CCO,391.0
N#Cc1cnc(-c2c3ccccc3c(-c3ncc(C#N)cn3)c3ccccc23)nc1,ClCCl,394.0
N#Cc1cnc(-c2c3ccccc3cc3ccccc23)nc1,CCO,382.0
N#Cc1cnc(-c2c3ccccc3cc3ccccc23)nc1,ClCCl,385.0
N#Cc1coc2ccccc2c1=O,C1CCOC1,316.0
N#Cc1coc2ccccc2c1=O,C1COCCO1,314.0
N#Cc1coc2ccccc2c1=O,CC#N,367.0
N#Cc1coc2ccccc2c1=O,CC(C)O,350.0
N#Cc1coc2ccccc2c1=O,CCCCO,355.0
N#Cc1coc2ccccc2c1=O,CCCO,336.0
N#Cc1coc2ccccc2c1=O,CCOC(C)=O,354.0
N#Cc1coc2ccccc2c1=O,CN(C)C=O,356.0
N#Cc1coc2ccccc2c1=O,CO,364.0
N#Cc1coc2ccccc2c1=O,CS(C)=O,360.0
N#Cc1coc2ccccc2c1=O,ClC(Cl)Cl,372.0
N#Cc1coc2ccccc2c1=O,O,312.0
N#Cc1nc(N(Cc2ccc(Br)cc2)Cc2ccc(Br)cc2)c(C#N)nc1N(Cc1ccc(Br)cc1)Cc1ccc(Br)cc1,ClC(Cl)Cl,485.0
N#Cc1nc(N(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)c(C#N)nc1N(Cc1ccc(Cl)cc1)Cc1ccc(Cl)cc1,ClC(Cl)Cl,485.0
N#Cc1nc(N(Cc2ccc(I)cc2)Cc2ccc(I)cc2)c(C#N)nc1N(Cc1ccc(I)cc1)Cc1ccc(I)cc1,ClC(Cl)Cl,484.0
N#Cc1nc(N(Cc2ccccc2)Cc2ccccc2)c(C#N)nc1N(Cc1ccccc1)Cc1ccccc1,ClC(Cl)Cl,493.0
N#Cc1nc(N(Cc2ccccc2Br)Cc2ccccc2Br)c(C#N)nc1N(Cc1ccccc1Br)Cc1ccccc1Br,ClC(Cl)Cl,485.0
N#Cc1nc(N(Cc2ccccc2Cl)Cc2ccccc2Cl)c(C#N)nc1N(Cc1ccccc1Cl)Cc1ccccc1Cl,ClC(Cl)Cl,485.0
N#Cc1nc(N(Cc2ccccc2I)Cc2ccccc2I)c(C#N)nc1N(Cc1ccccc1I)Cc1ccccc1I,ClC(Cl)Cl,487.0
N#Cc1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,C1COCCO1,313.0
N#Cc1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,CC#N,313.0
N#Cc1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,CO,318.0
N#Cc1nc2c(OCc3ccccc3)nc(N)nc2n1Cc1ccccc1,ClCCl,311.0
N#Cc1nc2c(nc1C#N)C1c3ccc(N(c4ccccc4)c4ccccc4)cc3C2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1CCCCC1,408.0
N#Cc1nc2c(nc1C#N)C1c3ccc(N(c4ccccc4)c4ccccc4)cc3C2c2ccc(N(c3ccccc3)c3ccccc3)cc21,CC#N,378.0
N#Cc1nc2c(nc1C#N)C1c3ccc(N(c4ccccc4)c4ccccc4)cc3C2c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,391.0
N#Cc1nc2c(nc1C#N)C1c3ccc(N(c4ccccc4)c4ccccc4)cc3C2c2ccc(N(c3ccccc3)c3ccccc3)cc21,ClCCl,409.0
N#Cc1nc2c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc3c2nc1C#N,Cc1ccccc1,418.0
N#Cc1nc2c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc3c2nc1C#N,Cc1ccccc1,460.0
N#Cc1ncc(-c2c3ccccc3c(-c3cnc(C#N)nc3)c3ccccc23)cn1,CCO,395.0
N#Cc1ncc(-c2c3ccccc3c(-c3cnc(C#N)nc3)c3ccccc23)cn1,ClCCl,397.0
N#Cc1nn(-c2c(Cl)cccc2Cl)nc1N1CCCC1,CC#N,317.0
N#Cc1nn(-c2cc(F)cc(F)c2)nc1N1CCCC1,CC#N,350.0
N#Cc1nn(-c2ccc(Cl)cc2)nc1N1CCCC1,CC#N,346.0
N#Cc1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1,C1CCOC1,364.0
N#Cc1nn(-c2cccc(C(F)(F)F)c2)nc1N1CCCC1,CC#N,347.0
N#Cc1nn(-c2ccccc2C(F)(F)F)nc1N1CCCC1,CC#N,326.0
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,C1CCCCC1,326.0089978
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,C1CCOC1,364.0467436
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,C1COCCO1,365.6841951
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,CC#N,381.4464449
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,CCOC(C)=O,364.0069889
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,CN(C)C=O,376.7045883
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,CO,386.6228494
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,CS(C)=O,368.7859566
N#Cc1nnn(-c2ccnc3cc(Cl)ccc23)c1N,ClC(Cl)Cl,385.000385
N=C(N)N,O,265.0
N=C(N)c1ccc(-c2cc3ccc(C(=N)N)cc3[nH]2)cc1,O,344.0
N=C(N)c1ccc(OCOc2ccc(C(=N)N)cc2)cc1,CO,650.0
N=C1C(=N)c2ccccc2OC1=O,ClC(Cl)Cl,374.0
N=C1Cc2ccccc2OC1=O,ClC(Cl)Cl,366.0
N=NC=NN,ClCCl,491.0
N=c1c2ccccc2c(Br)cn1Cn1cc(Br)c2ccccc2c1=O,CC(=O)O,293.0
N=c1oc2cccc3c4c(-c5ccccc5)oc5cccc(c(c1-c1ccccc1)c23)c54,ClC(Cl)Cl,397.0
N=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,C1CCOC1,355.0
N=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,CC#N,350.0
N=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,CS(C)=O,368.0
N=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,352.0
NC(=O)C1=CN([C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)C[C@@H]3O)O2)C=CC1,O,350.0
NC(=O)CC[C@H](/[NH+]=C\C=C1\C=C(C(=O)O)N[C@H](C(=O)O)C1)C(=O)O,CCO,474.0
NC(=O)CC[C@H](/[NH+]=C\C=C1\C=C(C(=O)O)N[C@H](C(=O)O)C1)C(=O)O,CO,471.0
NC(=O)CC[C@H](/[NH+]=C\C=C1\C=C(C(=O)O)N[C@H](C(=O)O)C1)C(=O)O,O,475.0
NC(=O)CC[C@H](/[NH+]=C\C=C1\C=C(C(=O)O)N[C@H](C(=O)O)C1)C(=O)O,OCC(F)(F)F,473.0
NC(=O)CC[C@H](/[NH+]=C\C=C1\C=C(C(=O)O)N[C@H](C(=O)O)C1)C(=O)O,OCCO,478.0
NC(=O)C[C@H](N)C(=O)OCc1ccccc1,CCO,330.0
NC(=O)Cc1cccc2ccccc12,C1COCCO1,283.0
NC(=O)Cc1cccc2ccccc12,CC#N,282.0
NC(=O)Cc1cccc2ccccc12,CCO,282.0
NC(=O)Cc1cccc2ccccc12,ClC(Cl)Cl,283.0
NC(=O)Cc1cccc2ccccc12,O,280.0
NC(=O)Cc1cccc2ccccc12,OCCO,283.0
NC(=O)Cc1cccc2ccccc12,[2H]O[2H],280.0
NC(CC(=O)c1cccc2oc3cc(=O)c4[nH]c(C(=O)O)cc(=O)c4c-3nc12)C(=O)O,O,459.0
NC(CO)C(=O)O,CS(C)=O,276.0
NC(Cc1c[nH]c2ccccc12)C(=O)O,O,275.0
NC(Cc1ccccc1)C(=O)O,O,241.0
NC1=C(Cl)C(=O)C(NCc2ccccc2)=C(Cl)C1=O,ClC(Cl)Cl,545.0
NC1=C2C=CC=[N+]2[B-](F)(F)n2cccc21,CCOC(C)=O,406.0
NC1=N/C(=N\c2ccccn2)c2cccc3cccc1c23,ClCCl,365.0
NC1CCCCC1N,O,393.0
NCCCCCCCCCCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCCCCCCCCCCCN)C5=O,CN(C)C=O,523.0
NCCCCCCCCCCCCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)NC5=O,CN(C)C=O,523.0
NCCNc1cccc2c1C(=O)c1ccccc1C2=O,ClCCl,510.0
NCCO,CCO,592.0
NCc1ccc2ccc3cccc4ccc1c2c34,CC#N,341.0
NCc1ccc2ccc3cccc4ccc1c2c34,CO,340.0
NCc1ccc2ccc3cccc4ccc1c2c34,ClC(Cl)Cl,344.0
NCc1ccccc1-c1ccccc1-c1nc2ccccc2s1,CO,378.0
NN1C(=O)c2cccc3cccc(c23)C1=O,CS(C)=O,340.0
NN=C(O)C(CCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)c1ccc2cccc(O)c2n1,CO,283.0
NN=Cc1c(O)ccc2ccccc12,CCO,304.0
NNC(=O)Cc1ccccc1F,CCO,357.0
NNC(=O)c1ccc(/C=C/c2ccc(C(=O)NN)cc2)cc1,CN(C)C=O,333.0
NPOP,Cc1ccccc1,707.0
NS(=O)(=O)c1ccc(-n2cccc2)cc1N1CCOCCOCCOCCOCC1,CC#N,278.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,C1CCOC1,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,C1COCCO1,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,CC#N,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,CC(C)O,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,CCO,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,CCOC(C)=O,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,CN(C)C=O,361.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,CO,356.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,CS(C)=O,364.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Br)cc2)cc1,O,359.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,C1CCOC1,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,C1COCCO1,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,CC#N,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,CC(C)O,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,CCO,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,CCOC(C)=O,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,CN(C)C=O,361.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,CO,356.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,CS(C)=O,363.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(Cl)cc2)cc1,O,359.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,C1CCOC1,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,C1COCCO1,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,CC#N,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,CC(C)O,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,CCO,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,CCOC(C)=O,356.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,CN(C)C=O,360.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,CO,356.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,CS(C)=O,363.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc(F)cc2)cc1,O,359.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,C1CCOC1,353.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,C1COCCO1,353.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,CC#N,352.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,CC(C)O,352.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,CCO,352.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,CCOC(C)=O,352.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,CN(C)C=O,355.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,CO,351.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,CS(C)=O,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccc([N+](=O)[O-])cc2)cc1,O,354.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,C1CCOC1,359.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,C1COCCO1,359.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,CC#N,358.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,CC(C)O,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,CCO,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,CCOC(C)=O,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,CN(C)C=O,361.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,CO,357.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,CS(C)=O,364.0
NS(=O)(=O)c1ccc(N2N=C(c3ccc(O)cc3)CC2c2ccccc2)cc1,O,359.0
NS(=O)(=O)c1ccc([N+](=O)[O-])cc1,CC#N,261.0
N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O,CS(C)=O,292.0
N[C@@H](Cc1ccc(O)cc1)C(=O)O,O,285.0
Nc1c(C(=O)O)cc(O)c2c1C(=O)c1ccccc1C2=O,CO,556.0
Nc1c(N=Nc2ccc(Cl)cc2)c(=O)[nH]c2nc3ccccc3n12,ClC(Cl)Cl,400.0
Nc1c(N=Nc2ccc([N+](=O)[O-])cc2)c(=O)[nH]c2nc3ccccc3n12,ClC(Cl)Cl,474.0
Nc1c(N=Nc2ccccc2)c(=O)[nH]c2nc3ccccc3n12,ClC(Cl)Cl,418.0
Nc1c(N=Nc2ccccc2Cl)c(=O)[nH]c2nc3ccccc3n12,ClC(Cl)Cl,425.0
Nc1c(N=Nc2ccccc2[N+](=O)[O-])c(=O)[nH]c2nc3ccccc3n12,ClC(Cl)Cl,419.0
Nc1cc(F)c(C(=O)c2cc(F)c(F)cc2F)cc1F,CCO,335.0
Nc1cc(F)c(C(=O)c2cc(F)c(N)cc2F)cc1F,CCO,340.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,C1CCCCC1,360.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,C1COCCO1,360.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,CC#N,360.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,CC(C)O,360.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,CCOC(C)=O,360.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,CCOCC,360.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,CO,360.0
Nc1cc(N)cc(-c2nc3ccccc3s2)c1,O,360.0
Nc1cc2ccc3cccc4ccc(c1)c2c34,CC#N,338.0
Nc1cc2ccc3cccc4ccc(c1)c2c34,CCCCOCCCC,338.0
Nc1cc2ccc3cccc4ccc(c1)c2c34,CO,336.0
Nc1cc2ccccc2cc1N,CO,340.0
Nc1cc2nc3cc(Br)c(Br)cc3nc2cc1N,CCO,442.0
Nc1cc2nc3cc(Cl)c(Cl)cc3nc2cc1N,CCO,442.0
Nc1cc2oc3cc(O)c(F)cc3c(=O)c2cc1F,CCO,366.0
Nc1cc[nH]c(=S)n1,CC#N,283.0
Nc1cc[nH]c(=S)n1,CCO,280.0
Nc1cc[nH]c(=S)n1,CCOC(C)=O,286.0
Nc1cc[nH]c(=S)n1,CO,278.0
Nc1cc[nH]c(=S)n1,CS(C)=O,285.0
Nc1cc[nH]c(=S)n1,O,269.0
Nc1ccc(-c2c3nc(c(-c4ccc(N)cc4)c4ccc([nH]4)c(-c4ccc(N)cc4)c4nc(c(-c5ccc(N)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,CN(C)C=O,670.0
Nc1ccc(-c2cc(-c3ccccc3)cc(-c3ccc(N)cc3)[o+]2)cc1,CCO,590.0
Nc1ccc(-c2ccc(N)cc2)cc1,C1CCOC1,306.0
Nc1ccc(-c2ccc(N)cc2)cc1,C1COCCO1,289.0
Nc1ccc(-c2ccc(N)cc2)cc1,CC#N,286.0
Nc1ccc(-c2ccc(N)cc2)cc1,CC(C)=O,285.0
Nc1ccc(-c2ccc(N)cc2)cc1,CCCCCC,279.0
Nc1ccc(-c2ccc(N)cc2)cc1,CCOC(C)=O,285.0
Nc1ccc(-c2ccc(N)cc2)cc1,CN(C)C=O,299.0
Nc1ccc(-c2ccc(N)cc2)cc1,CO,281.0
Nc1ccc(-c2ccc(N)cc2)cc1,CS(C)=O,292.0
Nc1ccc(-c2ccc(N)cc2)cc1,Cc1ccccc1,295.0
Nc1ccc(-c2ccc(N)cc2)cc1,ClC(Cl)Cl,305.0
Nc1ccc(-c2ccc(N)cc2)cc1,ClCCl,286.0
Nc1ccc(-c2ccc(N)cc2)cc1,O,281.0
Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1,C1CCOC1,443.0
Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1,CCCCCC,395.0
Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1,CCOC(C)=O,434.0
Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1,CCOCC,433.0
Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1,Cc1ccccc1,417.0
Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1,ClC(Cl)(Cl)Cl,415.0
Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1,ClCCl,419.0
Nc1ccc(-c2nc3ccccc3s2)c(O)c1,O,365.0
Nc1ccc(/C=C/c2cccnc2)cc1,CC#N,342.0
Nc1ccc(/C=C/c2cccnc2)cc1,CCCCCC,336.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,C1COCCO1,420.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,CC(C)=O,421.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,CCCCCC,421.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,CCCCCCO,421.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,CCO,419.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,CCOC(C)=O,419.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,CO,415.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,Cc1ccccc1,417.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(N)cc5)c5ccc2c3c45)cc1,ClCCl,417.0
Nc1ccc(C#Cc2ccc3ccc4ccc(C#Cc5ccc(NS(=O)(=O)c6ccc([N+](=O)[O-])cc6[N+](=O)[O-])cc5)c5ccc2c3c45)cc1,CO,406.0
Nc1ccc(C(=O)[O-])c(O)c1,CO,303.0
Nc1ccc(C(=O)[O-])c(O)c1,O,298.0
Nc1ccc(C=C2Oc3ccccc3C2=O)cc1,CO,442.0
Nc1ccc(N)c2c1C(=O)c1ccccc1C2=O,CC#N,544.0
Nc1ccc(N2C(=O)c3ccc4c5ccc6c7c(ccc(c8ccc(c3c48)C2=O)c75)C(=O)N(c2ccc(N)cc2)C6=O)cc1,CN(C)C=O,537.0
Nc1ccc(N2C(=O)c3ccc4c5ccc6c7c(ccc(c8ccc(c3c48)C2=O)c75)C(=O)N(c2ccc(O)cc2)C6=O)cc1,CN(C)C=O,525.0
Nc1ccc(N2C(=O)c3ccc4c5ccc6c7c(ccc(c8ccc(c3c48)C2=O)c75)C(=O)NC6=O)cc1,CN(C)C=O,524.0
Nc1ccc(O)c(-c2nc3ccccc3s2)c1,c1ccccc1,400.0
Nc1ccc(O)c(C(=O)[O-])c1,CO,334.0
Nc1ccc(O)c(C(=O)[O-])c1,O,331.0
Nc1ccc(O)cc1,O,394.0
Nc1ccc2[nH]ncc2c1,C1CCCCC1,326.0
Nc1ccc2c(-c3cc(F)c(F)c(F)c3)c3ccc(=[NH2+])cc-3oc2c1,O,510.0
Nc1ccc2c(-c3cc4ccccc4c4ccccc34)c3ccc(=[NH2+])cc-3sc2c1,O,530.0
Nc1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccc(=[NH2+])cc-3sc2c1,O,520.0
Nc1ccc2c(-c3ccc(Br)cc3)c3ccc(=[NH2+])cc-3oc2c1,CCO,514.0
Nc1ccc2c(-c3ccc(C(=O)CN4C(=O)CCC4=O)cc3C(=O)[O-])c3ccc(=[NH2+])c(S(=O)(=O)[O-])c-3oc2c1S(=O)(=O)[O-],O,494.0
Nc1ccc2c(-c3ccc(C(=O)NCCCCCC(=O)O)cc3C(=O)O)c3ccc(N)cc3[o+]c2c1,CCO,507.0
Nc1ccc2c(-c3ccc(C(=O)O)cc3C(=O)O)c3ccc(N)c(S(=O)(=O)NCCCS(=O)(=O)O)c3[o+]c2c1S(=O)(=O)O,O,491.0
Nc1ccc2c(-c3ccc(C(=O)O)cc3C(=O)O)c3ccc(N)c(S(=O)(=O)NCCCS(=O)(=O)O)c3[o+]c2c1S(=O)(=O)[O-],O,491.0
Nc1ccc2c(-c3ccc(C(=O)O)cc3C(=O)O)c3ccc(N)c(S(=O)(=O)NCCCS(=O)(=O)[O-])c3[o+]c2c1S(=O)(=O)[O-],O,491.0
Nc1ccc2c(-c3ccc(C4OCCCO4)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,505.0
Nc1ccc2c(-c3ccc(C4OCCCO4)cc3)c3ccc(=[NH2+])cc-3sc2c1,O,525.0
Nc1ccc2c(-c3ccc(CN4CCC5(CC4)OCCO5)cc3)c3ccc(=[NH2+])cc-3oc2c1,O,505.0
Nc1ccc2c(-c3ccc(CN4CCC5(CC4)OCCO5)cc3)c3ccc(=[NH2+])cc-3sc2c1,O,525.0
Nc1ccc2c(-c3ccc(Cl)s3)c3ccc(=[NH2+])cc-3oc2c1,O,525.0
Nc1ccc2c(-c3ccc(F)cc3)c3ccc(=[NH2+])cc-3sc2c1,O,520.0
Nc1ccc2c(-c3ccc(OC4CCCCO4)cc3)c3ccc(=[NH2+])cc-3sc2c1,O,520.0
Nc1ccc2c(-c3ccc4c(c3)OCO4)c3ccc(=[NH2+])cc-3oc2c1,O,500.0
Nc1ccc2c(-c3ccc4c(c3)OCO4)c3ccc(=[NH2+])cc-3sc2c1,O,525.0
Nc1ccc2c(-c3ccc4ccccc4c3)c3ccc(=[NH2+])cc-3oc2c1,O,500.0
Nc1ccc2c(-c3ccc4ccccc4c3)c3ccc(=[NH2+])cc-3sc2c1,O,520.0
Nc1ccc2c(-c3cccc(Cl)c3)c3ccc(=[NH2+])cc-3oc2c1,O,505.0
Nc1ccc2c(-c3cccc(Cl)c3)c3ccc(=[NH2+])cc-3sc2c1,O,525.0
Nc1ccc2c(-c3cccc(F)c3)c3ccc(=[NH2+])cc-3oc2c1,O,500.0
Nc1ccc2c(-c3ccccc3)c3ccc(=[NH2+])cc-3oc2c1,O,500.0
Nc1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[NH2+])cc-3oc2c1,CC#N,500.0
Nc1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[NH2+])cc-3oc2c1,CCO,499.0
Nc1ccc2c(-c3ccccc3C(=O)[O-])c3ccc(=[NH2+])cc-3oc2c1,CN(C)C=O,515.0
Nc1ccc2c(-c3ccccc3CO)c3ccc(=[NH2+])cc-3[se]c2c1,O,533.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,C1CCC2CCCCC2C1,349.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,C1CCCCC1,348.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,C1COCCO1,364.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC#N,366.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC(C)=O,371.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC(C)O,384.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CC1CCCCC1,348.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCC(C)CC,347.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCC(C)C,347.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCCCC,347.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCCCCCCO,383.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCCCCO,384.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCCCO,383.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCO,383.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CCOC(C)=O,368.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CN(C)C=O,378.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CO,378.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,CS(C)=O,386.0
Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1,ClCCl,360.0
Nc1ccc2c(c1)-c1ccccc1C2=O,C1CCCCC1,386.0
Nc1ccc2c(c1)-c1ccccc1C2=O,CC#N,409.0
Nc1ccc2c(c1)-c1ccccc1C2=O,CCO,429.0
Nc1ccc2c(c1)-c1ccccc1C2=O,c1ccccc1,395.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,C1CCCCC1,340.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,C1CCOC1,362.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,CC#N,362.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,CCOC(C)=O,360.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,CO,373.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,CS(C)=O,380.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,Cc1ccccc1,353.0
Nc1ccc2c(c1)C(=O)N(C13C[C@H]4C[C@@H](C1)C[C@@H](C3)C4)C2=O,ClCCl,353.0
Nc1ccc2c(c1)C(=O)NC2=O,C1CCOC1,357.0
Nc1ccc2c(c1)C(=O)NC2=O,C1COCCO1,352.0
Nc1ccc2c(c1)C(=O)NC2=O,CC#N,357.0
Nc1ccc2c(c1)C(=O)NC2=O,CC(C)(C)O,370.0
Nc1ccc2c(c1)C(=O)NC2=O,CC(C)=O,357.0
Nc1ccc2c(c1)C(=O)NC2=O,CC(C)O,367.0
Nc1ccc2c(c1)C(=O)NC2=O,CCOCC,350.0
Nc1ccc2c(c1)C(=O)NC2=O,CO,368.0
Nc1ccc2c(c1)C(=O)NC2=O,O,370.0
Nc1ccc2c(c1)C(=O)c1ccc(N)cc1C2=O,CC#N,438.0
Nc1ccc2c(c1)C(=O)c1ccc(N)cc1C2=O,CC(C)O,484.0
Nc1ccc2c(c1)C(=O)c1ccc(N)cc1C2=O,CCO,477.0
Nc1ccc2c(c1)C(=O)c1ccc(N)cc1C2=O,CCOC(C)=O,433.4
Nc1ccc2c(c1)C(=O)c1ccc(N)cc1C2=O,CO,474.0
Nc1ccc2c(c1)C(=O)c1ccccc1-2,C1CCCCC1,455.0
Nc1ccc2c(c1)C(=O)c1ccccc1-2,CC#N,481.0
Nc1ccc2c(c1)C(=O)c1ccccc1-2,CCO,488.0
Nc1ccc2c(c1)C(=O)c1ccccc1-2,c1ccccc1,469.0
Nc1ccc2c(c1)CCCc1c-2[o+]c2c(c1-c1ccccc1C(=O)O)CCCc1cc(N)ccc1-2,CCO,566.0
Nc1ccc2c(c1)Cc1c-2[o+]c2c(c1-c1c(F)c(F)c(F)c(F)c1F)Cc1cc(N)ccc1-2,CCO,546.0
Nc1ccc2c(c1)Cc1c-2[o+]c2c(c1-c1ccccc1)Cc1cc(N)ccc1-2,CCO,598.0
Nc1ccc2c(c1)Cc1c-2[o+]c2c(c1-c1ccccc1O)Cc1cc(N)ccc1-2,CCO,584.0
Nc1ccc2c(c1)Cc1c-2[o+]c2c3c4c(cc2c1-c1ccccc1C(=O)[O-])CCCN4CCC3,O,582.0
Nc1ccc2c(c1)Cc1c-2[o+]c2cc(Cl)ccc2c1-c1ccccc1C(=O)[O-],O,484.0
Nc1ccc2c(c1)Cc1c-2[o+]c2cc(O)ccc2c1-c1ccccc1C(=O)[O-],O,522.0
Nc1ccc2c(c1)Cc1c-2[o+]c2ccccc2c1-c1ccccc1C(=O)[O-],O,478.0
Nc1ccc2c(c1)Cc1ccccc1-2,C1CCCCC1,318.0
Nc1ccc2c(c1)Cc1ccccc1-2,C1COCCO1,322.0
Nc1ccc2c(c1)Cc1ccccc1-2,CC#N,325.0
Nc1ccc2c(c1)Cc1ccccc1-2,CC(C)O,317.0
Nc1ccc2c(c1)Cc1ccccc1-2,CCCCCC,318.0
Nc1ccc2c(c1)Cc1ccccc1-2,CCCCCCC,317.0
Nc1ccc2c(c1)Cc1ccccc1-2,CCO,317.0
Nc1ccc2c(c1)Cc1ccccc1-2,CCOC(C)=O,325.0
Nc1ccc2c(c1)Cc1ccccc1-2,CCOCC,318.0
Nc1ccc2c(c1)Cc1ccccc1-2,CO,317.0
Nc1ccc2c(c1)Cc1ccccc1-2,ClCCl,319.0
Nc1ccc2c(c1)Cc1ccccc1-2,O,315.0
Nc1ccc2c(c1)NC(=O)CC(=O)N2,CS(C)=O,318.0
Nc1ccc2c(c1)oc(=O)c1c(=O)oc3ccccc3c12,CS(C)=O,438.0
Nc1ccc2c(c1)oc(=O)c1c(=O)oc3ccccc3c12,ClCCl,411.0
Nc1ccc2c(ccc3[n+]2[B-](F)(F)n2c-3cc3c4ccccc4c4ccccc4c32)c1,ClCCl,482.0
Nc1ccc2c(ccc3c(-c4ccc5nn[nH]c5c4)c4ccc5cc(N)ccc5c4[o+]c32)c1,O,612.0
Nc1ccc2c(ccc3c(-c4ccccc4C(=O)[O-])c4ccc(=[NH2+])cc-4oc32)c1,O,533.0
Nc1ccc2c3c(c(=O)oc2c1S(=O)(=O)[O-])CCC3C(CC(=O)NCCCC(=O)O)S(=O)(=O)[O-],O,353.0
Nc1ccc2c3c(ccc2c1)C(c1ccccc1C(=O)[O-])=c1cc2c4c(c1O3)CCC[N+]=4CCC2,O,577.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,C1CCCCC1,452.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,C1CCOC1,468.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,C1COCCO1,464.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CC#N,467.3333333333333
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CC(C)=O,471.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CCCCOCCCC,455.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CCOC(C)=O,463.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CN(C)C=O,482.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,CO,460.0
Nc1ccc2c3cccc4cccc(c5cccc1c52)c43,ClCCl,465.0
Nc1ccc2cc3ccccc3cc2c1,C1CCCCC1,397.6143141
Nc1ccc2ccc(O)cc2c1,O,332.0
Nc1ccc2ccc([O-])cc2c1,O,342.0
Nc1ccc2ccc3cccc4ccc1c2c34,CC#N,361.0
Nc1ccc2ccc3cccc4ccc1c2c34,CCCCOCCCC,361.0
Nc1ccc2ccc3cccc4ccc1c2c34,CO,357.0
Nc1ccc2cn[nH]c2c1,C1CCCCC1,296.0
Nc1ccc2nc(-c3ccc(-c4cccs4)s3)cc(-c3ccccc3)c2c1,CN1CCCC1=O,420.0
Nc1ccc2nc(-c3ccccc3)c(=O)oc2c1,c1ccccc1,402.0
Nc1ccc2nc3ccc(=[NH2+])cc-3oc2c1,CO,583.0
Nc1ccc2ncccc2c1,CS(C)=O,361.0
Nc1cccc(-c2c3nc(c(-c4cccc(N)c4)c4ccc([nH]4)c(-c4cccc(N)c4)c4nc(c(-c5cccc(N)c5)c5ccc2[nH]5)C=C4)C=C3)c1,CN(C)C=O,649.0
Nc1cccc(N)n1,C1CCOC1,389.0
Nc1cccc2c1-c1ccccc1C2=O,C1CCCCC1,427.0
Nc1cccc2c1-c1ccccc1C2=O,CC#N,451.0
Nc1cccc2c1-c1ccccc1C2=O,CCO,458.0
Nc1cccc2c1-c1ccccc1C2=O,c1ccccc1,440.0
Nc1cccc2c1C(=O)c1ccccc1-2,C1CCCCC1,407.0
Nc1cccc2c1C(=O)c1ccccc1-2,CC#N,420.0
Nc1cccc2c1C(=O)c1ccccc1-2,CCO,431.0
Nc1cccc2c1C(=O)c1ccccc1-2,c1ccccc1,416.0
Nc1cccc2c1C(=O)c1ccccc1C2=O,CC#N,466.0
Nc1cccc2c1C(=O)c1ccccc1C2=O,ClCCl,464.0
Nc1cccc2cc3ccccc3cc12,C1CCCCC1,384.1721091
Nc1cccc2cccc(N)c12,CC#N,349.0
Nc1cccc2cccc(N)c12,CO,334.0
Nc1cccc2cccc(N)c12,CS(C)=O,354.0
Nc1cccc2cccc(N)c12,Cc1ccccc1,334.0
Nc1cccc2ccccc12,C1CCCCC1,311.7206983
Nc1cccc2cn[nH]c12,C1CCCCC1,296.0
Nc1cccc2cn[nH]c12,O,294.0
Nc1cccc2ncccc12,CC#N,340.0
Nc1cccc2ncccc12,O,333.0
Nc1ccccc1,C1CCCCC1,283.1257078
Nc1ccccc1,CCCCCC,243.0
Nc1ccccc1-c1nc2ccccc2s1,CO,365.0
Nc1ccccc1/C=C/C(F)(F)F,C1CCOC1,347.0
Nc1ccccc1C(=O)CC(N)C(=O)O,O,363.0
Nc1ccccc1C(=O)O,C1CCCCC1,338.0
Nc1ccccc1C(=O)O,C1COCCO1,338.0
Nc1ccccc1C(=O)O,CC#N,336.0
Nc1ccccc1C(=O)O,CC(C)=O,336.0
Nc1ccccc1C(=O)O,CCO,334.0
Nc1ccccc1C(=O)O,CO,334.0
Nc1ccccc1C(=O)O,CS(C)=O,342.0
Nc1ccccc1C(=O)O,OCC(F)(F)F,320.0
Nc1ccccc1C(=O)O,c1ccccc1,340.0
Nc1n[n+]([O-])c2ccccc2[n+]1[O-],CC#N,477.0
Nc1n[n+]([O-])c2ccccc2[n+]1[O-],O,457.0
Nc1nc(-c2ccc(NC(=O)c3ccccc3)cc2)c(N=Nc2ccc(Br)cc2)s1,CS(C)=O,487.0
Nc1nc(-c2ccc(NC(=O)c3ccccc3)cc2)c(N=Nc2ccc(Cl)cc2)s1,CS(C)=O,487.0
Nc1nc(-c2ccc(NC(=O)c3ccccc3)cc2)c(N=Nc2cccc([N+](=O)[O-])c2)s1,CS(C)=O,493.0
Nc1nc(-c2ccc(NC(=O)c3ccccc3)cc2)c(N=Nc2ccccc2)s1,CS(C)=O,478.0
Nc1nc(-c2ccc(NC(=O)c3ccccc3)cc2)c(N=Nc2ccccc2Cl)s1,CS(C)=O,492.0
Nc1nc(-c2ccc(NC(=O)c3ccccc3)cc2)c(N=Nc2ccccc2[N+](=O)[O-])s1,CS(C)=O,505.0
Nc1nc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1,Cc1ccccc1,417.0
Nc1nc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1,ClC(Cl)Cl,432.0
Nc1nc2c(ncn2[C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)[nH]1,O,274.0026304
Nc1nc2ccc(Br)cc2s1,CC#N,269.0
Nc1nc2ccc(Br)cc2s1,ClCCl,268.0
Nc1nc2ccc(F)cc2[n+]([O-])n1,CC#N,415.0
Nc1nc2ccc(F)cc2[n+]([O-])n1,O,422.0
Nc1nc2ccc([N+](=O)[O-])cc2s1,CC#N,355.0
Nc1nc2ccc([N+](=O)[O-])cc2s1,ClCCl,346.0
Nc1ncc2[nH]cnc2n1,CCO,310.0
Nc1ncc2nc[nH]c2n1,O,290.0
Nc1ncccn1,CS(C)=O,296.0
Nc1ncnc2c1c(C#Cc1c3ccccc3cc3ccccc13)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CC#N,405.0
Nc1ncnc2c1c(C#Cc1c3ccccc3cc3ccccc13)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CCO,405.0
Nc1ncnc2c1c(C#Cc1c3ccccc3cc3ccccc13)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CCOC(C)=O,405.0
Nc1ncnc2c1c(C#Cc1c3ccccc3cc3ccccc13)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CO,403.0
Nc1ncnc2c1c(C#Cc1c3ccccc3cc3ccccc13)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,ClC(Cl)Cl,407.0
Nc1ncnc2c1c(C#Cc1ccc3ccccc3c1)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CC#N,318.0
Nc1ncnc2c1c(C#Cc1ccc3ccccc3c1)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CCO,318.0
Nc1ncnc2c1c(C#Cc1ccc3ccccc3c1)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CCOC(C)=O,318.0
Nc1ncnc2c1c(C#Cc1ccc3ccccc3c1)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,CO,315.0
Nc1ncnc2c1c(C#Cc1ccc3ccccc3c1)cn2[C@H]1C[C@H](O)[C@@H](CO)O1,ClC(Cl)Cl,319.0
Nc1ncnc2c1ncn2C1OC(CO)C(O)C1O,C1CCCCC1,357.9
Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O1,Cc1ccccc1,519.0
Nc1nn2c(-c3ccccc3)ccnc2c1N=Nc1ccc(Cl)cc1,C1CCCCC1,410.0
Nc1nn2c(-c3ccccc3)ccnc2c1N=Nc1ccc([N+](=O)[O-])cc1,C1CCCCC1,415.0
Nn1c(Cc2ccccc2F)n[nH]c1=S,CC#N,357.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,C1CCOC1,329.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,CC#N,325.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,CCCC#N,325.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,CCO,328.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,CN(C)C=O,329.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,CO,328.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,CS(C)=O,335.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,ClCCl,324.0
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O,O,325.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,C1CCOC1,406.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,C1COCCO1,405.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,CCO,400.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,CCOC(C)=O,402.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,CN(C)C=O,381.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,CO,352.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,CS(C)=O,401.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,Cc1ccccc1,409.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,ClC(Cl)Cl,405.0
O=C(/C=C/c1cn(-c2ccccc2)nc1-c1ccccc1)c1c(O)c2ccccc2oc1=O,ClCCl,404.0
O=C(C(=O)c1ccccc1)c1ccccc1,CCOC(C)=O,484.0
O=C(C=Cc1ccccc1)CC(=O)C=Cc1ccccc1,CC#N,390.0
O=C(C=Cc1ccccc1)c1ccccc1,CC#N,491.0
O=C(C=Cc1cn(Cc2ccccc2)c2ccccc12)c1ccc2ccccc2c1,ClCCl,405.0
O=C(CBr)c1ccc(OC(=O)c2c3ccccc3cc3ccccc23)cc1,CO,362.0
O=C(CC1(S(=O)(=O)c2ccc(Oc3ccccc3)cc2)CCOCC1)NO,CO,540.0
O=C(CCCc1ccc2ccc3cccc4ccc1c2c34)OC1C(=O)C=CC1=O,CO,340.0
O=C(CI)NCc1ccc2ccc3cccc4ccc1c2c34,CO,341.0
O=C(CI)Nc1ccc2ccc3cccc4ccc1c2c34,CO,339.0
O=C(CI)OCc1cc2cccc3ccc4cccc1c4c32,CO,341.0
O=C(COc1ccc(/C=C/c2ccc3n2[B-](F)(F)[N+]2=C(c4cccs4)C=CC2=C3)cc1)NCCCCCC(=O)N1C(=O)CCC1=O,CO,625.0
O=C(COc1ccc(Cl)cc1/C=N/N=C/c1cc(Cl)ccc1OCC(=O)c1ccccc1)c1ccccc1,C1CCOC1,355.0
O=C(COc1ccccc1/C=N/N=C/c1ccccc1OCC(=O)c1ccccc1)c1ccccc1,C1CCOC1,344.0
O=C(CSCCCCCC(=O)ON1C(=O)C=CC1=O)Nc1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1,O,491.0
O=C(Cc1ccc2ccc3cccc4ccc1c2c34)OC1C(=O)C=CC1=O,CO,340.0
O=C(Cc1ccccc1)OCc1ccc2c3cccc4cccc(c5cccc1c52)c43,CCO,438.0
O=C(Cl)Cc1ccccc1F,CO,357.0
O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O,C1CCOC1,335.0
O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O,CC#N,339.0
O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O,CC(C)=O,350.0
O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O,CCO,400.0
O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O,CN(C)C=O,340.0
O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O,CS(C)=O,400.0
O=C(N/N=C/c1ccccc1O)c1cc2ccccc2cc1O,ClCCl,334.0
O=C(N/N=C/c1ccccc1O)c1ccc([N+](=O)[O-])cc1,C1CCOC1,338.0
O=C(N/N=C/c1ccccc1O)c1ccc([N+](=O)[O-])cc1,CC#N,339.0
O=C(N/N=C/c1ccccc1O)c1ccc([N+](=O)[O-])cc1,CC(C)=O,350.0
O=C(N/N=C/c1ccccc1O)c1ccc([N+](=O)[O-])cc1,CCO,345.0
O=C(N/N=C/c1ccccc1O)c1ccc([N+](=O)[O-])cc1,CN(C)C=O,380.0
O=C(N/N=C/c1ccccc1O)c1ccc([N+](=O)[O-])cc1,CS(C)=O,342.0
O=C(N/N=C/c1ccccc1O)c1ccc([N+](=O)[O-])cc1,ClCCl,340.0
O=C(N/N=C/c1ccccc1O)c1cccc2ccccc12,C1CCOC1,334.0
O=C(N/N=C/c1ccccc1O)c1cccc2ccccc12,CC#N,332.0
O=C(N/N=C/c1ccccc1O)c1cccc2ccccc12,CC(C)=O,343.0
O=C(N/N=C/c1ccccc1O)c1cccc2ccccc12,CCO,400.0
O=C(N/N=C/c1ccccc1O)c1cccc2ccccc12,CN(C)C=O,395.0
O=C(N/N=C/c1ccccc1O)c1cccc2ccccc12,CS(C)=O,329.0
O=C(N/N=C/c1ccccc1O)c1cccc2ccccc12,ClCCl,328.0
O=C(N/N=C/c1ccccc1O)c1ccccc1,C1CCOC1,334.0
O=C(N/N=C/c1ccccc1O)c1ccccc1,CC#N,333.0
O=C(N/N=C/c1ccccc1O)c1ccccc1,CC(C)=O,415.0
O=C(N/N=C/c1ccccc1O)c1ccccc1,CCO,400.0
O=C(N/N=C/c1ccccc1O)c1ccccc1,CN(C)C=O,397.0
O=C(N/N=C/c1ccccc1O)c1ccccc1,CS(C)=O,329.0
O=C(N/N=C/c1ccccc1O)c1ccccc1,ClCCl,330.0
O=C(NCC12CC3CC(C1)CC(CNC(=O)Nc1ccc4cc5ccccc5cc4c1)(C3)C2)Nc1ccc2cc3ccccc3cc2c1,CS(C)=O,407.0
O=C(NCc1cc(=O)oc2cc(O)c(Br)cc12)c1cccnc1,CC#N,392.0
O=C(NCc1cc(=O)oc2cc(O)c(Br)cc12)c1cccnc1,CO,372.0
O=C(NCc1cc(=O)oc2cc(O)c(Br)cc12)c1cccnc1,CS(C)=O,408.0
O=C(NCc1cc(=O)oc2cc(O)c(Br)cc12)c1cccnc1,O,330.0
O=C(NCc1cc(=O)oc2cc([O-])c(Br)cc12)c1cccnc1,O,370.0
O=C(NCc1ccccc1)c1sc(-c2ccc(-c3cc(C4CC4)c(C(=O)NCc4ccccc4)s3)s2)cc1C1CC1,ClCCl,393.0
O=C(NN=Cc1ccccc1O)c1cc2ccccc2cc1O,CO,237.0
O=C(NO)C1(CS(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)CCOCC1,CO,527.0
O=C(Nc1ccc(-c2c3nc(c(-c4ccc(C(F)(F)F)cc4)c4ccc([nH]4)c(-c4ccc(C(F)(F)F)cc4)c4nc(c(-c5ccc(C(F)(F)F)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1)c1ccccc1,Cc1ccccc1,650.0
O=C(Nc1ccc2cc3ccccc3cc2c1)NC12CC3CC(C1)CC(NC(=O)Nc1ccc4cc5ccccc5cc4c1)(C3)C2,CS(C)=O,407.0
O=C(Nc1cccc(-c2c3nc(c(-c4cccc(NC(=O)C(F)(F)F)c4)c4ccc([nH]4)c(-c4cccc(NC(=O)C(F)(F)F)c4)c4nc(c(-c5cccc(NC(=O)C(F)(F)F)c5)c5ccc2[nH]5)C=C4)C=C3)c1)C(F)(F)F,CN(C)C=O,646.0
O=C(Nc1cccc2ccccc12)NC12CC3CC(C1)CC(NC(=O)Nc1cccc4ccccc14)(C3)C2,CS(C)=O,327.0
O=C(Nc1ccccc1[N+](=O)[O-])c1ccc2oc(-c3cc4ccccc4oc3=O)nc2c1,ClCCl,360.0
O=C(O)/C(=C/c1ccc(N(c2ccccc2)c2ccc(/C=C(/C(=O)O)c3nnn[nH]3)cc2)cc1)c1nnn[nH]1,ClCCl,390.0
O=C(O)/C=C/c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCO,369.0
O=C(O)/C=C/c1ccc2c(c1)c1ccccc1n2-c1ccc(C(F)(F)F)cc1,CC#N,374.0
O=C(O)/C=C/c1ccc2c(c1)c1ccccc1n2-c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,407.0
O=C(O)/C=C/c1ccc2c(c1)c1ccccc1n2-c1ccccc1,CC#N,396.0
O=C(O)/C=C/c1ccc2ccccc2c1-c1cccc2c1C(=O)/C(=C1/Nc3ccccc3C1=O)N2,C1CCOC1,549.0
O=C(O)/C=C/c1ccc2ccccc2c1-c1cccc2c1C(=O)/C(=C1\Nc3ccccc3C1=O)N2,C1CCOC1,549.0
O=C(O)/C=C/c1ccc2ccccc2c1-c1cccc2c1C(=O)/C(=C1\Sc3ccccc3C1=O)S2,C1CCOC1,486.0
O=C(O)/C=C\c1ccc2c(c1)Sc1ccccc1N2c1ccccc1,CC#N,404.0
O=C(O)C(=C/C=C/C1=C/C2=C(\c3ccccc3)c3ccc4n3[Zn]n3/c(cc/c3=C(\c3ccccc3)C1=N2)=C(/c1ccccc1)C1=N/C(=C\4c2ccccc2)C=C1)C(=O)O,CN(C)C=O,610.0
O=C(O)C(=Cc1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1)C(=O)O,ClCCl,425.0
O=C(O)C(=Cc1ccc(C#C/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccccc2)=C2/C=CC(=N2)/C=4N(c2ccccc2)c2ccccc2)cc1)C(=O)O,C1CCOC1,449.0
O=C(O)C(=Cc1ccc(C#C/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(N(c3ccccc3)c3ccccc3)=C3/C=CC(=N3)/C=4c3ccccc3)/C(c3ccccc3)=C3/C=CC2=N3)cc1)C(=O)O,C1CCOC1,642.0
O=C(O)C1=C(C(=O)O)C2=C[C@H]3c4ccccc4[C@]2(S1)c1ccccc13,ClCCl,410.0
O=C(O)C1=C(C(=O)O)C2=C[C@H]3c4ccccc4[C@]2([Se]1)c1ccccc13,ClCCl,421.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@@H](C(=O)O)N1,CO,533.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@@H](C(=O)O)N1,O,535.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@@H](C(=O)O)N1,OCCO,539.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@@H](C(=O)O)N1,[2H]O[2H],536.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@H](C(=O)O)N1,CO,535.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@H](C(=O)O)N1,O,536.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@H](C(=O)O)N1,OCCO,541.0
O=C(O)C1=C/C(=C/C=[N+]2/c3cc(O)c(C[C@@H]4O[C@H](CO)[C@@H](O)C(O)[C@H]4O)cc3C[C@H]2C(=O)O)C[C@H](C(=O)O)N1,[2H]O[2H],535.0
O=C(O)C1=C/C(=C/C=[NH+]/c2ccc3c(C(F)(F)F)cc(=O)oc3c2)CC(C(=O)O)N1,O,519.0
O=C(O)C1=CC=C(C=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)CC1,CC#N,404.0
O=C(O)C1=CC=C(c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)s2)CC1,CC#N,417.0
O=C(O)C1=CC=C(c2ccc(-n3c4ccccc4c4ccccc43)cc2)CC1,CC#N,379.0
O=C(O)C1=CC=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)CC1,C1CCOC1,384.0
O=C(O)C1=CC=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)CC1,CC#N,387.0
O=C(O)C1=CC=C(c2ccc3c(c2)CCN3c2ccccc2)CC1,C1CCOC1,395.0
O=C(O)C=C/C1=c2\cc/c3n2[Zn]n2c(ccc2/C(c2ccccc2)=C2/C=CC(=N2)/C=3c2ccccc2)/C(c2ccccc2)=C2/C=CC1=N2,CCO,428.0
O=C(O)C=Cc1ccc(N(c2ccccc2)c2ccc(C=CC(=O)O)cc2)cc1,CN(C)C=O,392.0
O=C(O)C=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,370.0
O=C(O)CCCC(=O)Nc1ccc2nc(-c3cc[n+](CCCS(=O)(=O)[O-])cc3)oc2c1,O,375.0
O=C(O)CCCCCCCC(=O)O,ClC(Cl)Cl,480.0
O=C(O)CCCCCCN1C(=CC=Cc2oc3cc(S(=O)(=O)O)ccc3[n+]2CCCCCC(=O)O)Oc2cc(S(=O)(=O)[O-])ccc21,O,547.0
O=C(O)CCCCCCn1c2cc(-c3ccc(-c4ccncc4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,396.0
O=C(O)CCCCCCn1c2cc(-c3ccc(-c4cnccn4)s3)ccc2c2ccc(N(c3ccccc3)c3ccccc3)cc21,C1COCCO1,402.0
O=C(O)CCCCCNC(=O)COc1cc([SH](=O)([O-])O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43,O,400.0
O=C(O)CCCCCNC(=O)COc1ccc(/C=C/c2ccc3n2[B-](F)(F)[N+]2=C(c4cccs4)C=CC2=C3)cc1,CO,625.0
O=C(O)CCCCCNC(=O)N(CCCS(=O)(=O)[O-])c1ccc2nc(-c3cc[n+](CCCS(=O)(=O)[O-])cc3)oc2c1,O,347.0
O=C(O)CCCCCNC(=O)Nc1ccc2nc(-c3cc[n+](CCCS(=O)(=O)[O-])cc3)oc2c1,O,397.0
O=C(O)CCCCCNC(=O)c1cc2cc(S(=O)(=O)[O-])c(O)c(Cl)c2oc1=O,O,405.0
O=C(O)CCCCCNC(=O)c1ccc(-c2c3ccc(O)cc3[o+]c3cc(O)ccc23)c(C(=O)O)c1,O,494.0
O=C(O)CCCCCNC(=O)c1cccc2c(=O)c3ccccc3[nH]c12,O,409.0
O=C(O)CCCCCOc1cc2oc(/C=C/c3cc[n+](CCCS(=O)(=O)[O-])cc3)nc2cc1S(=O)(=O)[O-],O,387.0
O=C(O)CCCCCOc1ccc(/C=C/c2ccc3n2[B-](F)(F)[n+]2c4n(c5ccccc52)[B-](F)(F)[N+]2=CC=CC2=C34)cc1,ClCCl,695.0
O=C(O)CCCCCOc1ccc(C2=NN(c3ccc(S(=O)(=O)[O-])cc3)C(c3ccccc3S(=O)(=O)[O-])C2)cc1,O,362.0
O=C(O)CCCCCOc1ccc2nc(/C=C/c3cc[n+](CCCS(=O)(=O)[O-])cc3)oc2c1,O,394.0
O=C(O)CCCCC[n+]1ccc(-c2nc3ccc(OCCCS(=O)(=O)[O-])cc3o2)cc1,O,382.0
O=C(O)CCCCCn1/c(=C/C=C/C2=[N+](CCCCCC(=O)O)c3cccc4cccc2c34)c2cccc3cccc1c32,CO,760.0
O=C(O)CCCCCn1c2ccc(Br)cc2c(=O)c2cc(Br)ccc21,O,425.0
O=C(O)CCCCCn1c2ccc(Br)cc2c(=O)c2cc(S(=O)(=O)O)ccc21,O,416.0
O=C(O)CCCCCn1c2ccc(Br)cc2c(=O)c2cc3c(cc21)c(=O)c1cc(Br)ccc1n3CCCCCC(=O)O,CO,533.0
O=C(O)CCCCCn1c2ccccc2c(=O)c2cc(Br)ccc21,O,439.0
O=C(O)CCCCCn1c2ccccc2c(=O)c2cc(F)ccc21,O,420.0
O=C(O)CCCCCn1c2ccccc2c(=O)c2cc(S(=O)(=O)O)ccc21,O,409.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,C1CCOC1,372.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,C1COCCO1,373.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CC#N,374.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CC(C)=O,373.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CCCCCC,371.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CCO,372.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CN(C)C=O,374.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CO,371.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,CS(C)=O,377.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,Cc1ccccc1,377.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,ClC(Cl)Cl,380.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,ClCCl,381.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,O,360.0
O=C(O)CCCNC(=O)c1ccc2ccc3c(N4CCCCC4)ccc4ccc1c2c43,OCC(F)(F)F,360.0
O=C(O)CCCOc1cc2ccc3cccc4ccc(c1)c2c34,CO,382.0
O=C(O)CCCOc1cccc(-c2c3nc(cc4ccc([nH]4)c(-c4cccc(OCCCC(=O)O)c4)c4nc(cc5ccc2[nH]5)C=C4)C=C3)c1,CS(C)=O,630.0
O=C(O)CCCOc1cccc(-c2c3nc(cc4ccc([nH]4)c(-c4cccc(OCCCC(=O)O)c4)c4nc(cc5ccc2[nH]5)CC4)C=C3)c1,CS(C)=O,645.0
O=C(O)CCCOc1cccc(-c2c3nc(cc4ccc([nH]4)c(-c4cccc(OCCCC(=O)O)c4)c4nc(cc5ccc2[nH]5)CC4)CC3)c1,CS(C)=O,736.0
O=C(O)CCCc1cc(C#Cc2ccccc2)c2ccc3c(C#Cc4ccccc4)cc(C#Cc4ccccc4)c4ccc1c2c34,CS(C)=O,451.0
O=C(O)CCCc1cc(C#Cc2ccccc2)c2ccc3c(C#Cc4ccccc4)cc(C#Cc4ccccc4)c4ccc1c2c34,ClC(Cl)(Cl)Cl,445.0
O=C(O)CCCc1ccc2ccc3cccc4ccc1c2c34,CO,375.0
O=C(O)CCNc1cccc2ccccc12,CCO,330.0
O=C(O)CCOCCOCCNS(=O)(=O)c1ccc(-c2c3cc4c5c(c3[o+]c3c6c7c(cc23)CCCN7CCC6)CCCN5CCC4)c(S(=O)(=O)O)c1,CCO,581.0
O=C(O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,CC#N,619.0
O=C(O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,CO,617.0
O=C(O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,ClCCl,637.0
O=C(O)CC[N+]1=c2cc3c(cc2CCC1)=Cc1c(c2cc4c5c(c2oc1=O)CCCN5CCC4)O3,O,608.0
O=C(O)CCc1c2ccccc2cc2ccccc12,CO,366.0
O=C(O)CCc1cc2c(-c3ccc(C(=O)O)cc3C(=O)O)c3cc(CCC(=O)O)c(=O)cc-3oc2cc1O,O,501.0
O=C(O)CCl,O,687.0
O=C(O)CN1/C(=C/C2=C([O-])/C(=C/c3sc4ccccc4[n+]3CC(=O)O)C2=O)Sc2ccccc21,CO,660.0
O=C(O)CN1C(=O)/C(=C/c2cc3c(c4ccccc24)N(c2ccc(C=C(c4ccccc4)c4ccccc4)cc2)C2CCCC32)SC1=S,ClC(Cl)Cl,551.0
O=C(O)CN1C(=O)/C(=C/c2cc3c4c(c2)CCCN4CCC3)SC1=S,CCO,540.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-c3ccc(-c4ccc(-c5cc6c7c(c5)CCCN7CCC6)cc4)s3)s2)SC1=S,CCO,501.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-c3ccc(-c4ccc(-c5ccc(N6c7ccccc7C7C8CCC(C8)C76)cc5)s4)s3)s2)SC1=S,ClCCl,560.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-c3ccc(-c4ccc(N(c5ccc6c(c5)OCCO6)c5ccc6c(c5)OCCO6)cc4)s3)s2)SC1=S,ClCCl,526.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(N(c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc3)s2)SC1=S,C1CCOC1,472.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-c3nc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)nc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)n3)cc2)SC1=S,CN(C)C=O,403.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-c3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)cc2)SC1=S,CCO,421.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-c3sc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4c3OCCO4)s2)SC1=S,ClCCl,536.0
O=C(O)CN1C(=O)/C(=C/c2ccc(-n3c4ccccc4c4ccccc43)cc2)SC1=S,CC#N,401.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccc(-c4cccc5c4[nH]c4ccccc45)cc3)c3ccc(-c4cccc5c4[nH]c4ccccc45)cc3)cc2)SC1=S,CCO,477.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccc(/C=C4/SC(=S)N(CC(=O)O)C4=O)cc3)c3ccc(-c4cccc5c4[nH]c4ccccc45)cc3)cc2)SC1=S,CCO,491.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccc(/C=C4/SC(=S)N(CC(=O)O)C4=O)cc3)c3ccc(/C=C4/SC(=S)N(CC(=O)O)C4=O)cc3)cc2)SC1=S,CCO,480.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccc(/C=C4\SC(=S)N(CC(=O)O)C4=O)cc3)c3ccc(N4c5ccccc5Sc5ccccc54)cc3)cc2)SC1=S,CN(C)C=O,476.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccc(-c4cccc5c4[nH]c4ccccc45)cc3)cc2)SC1=S,CCO,470.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccc(/C=C4/SC(=S)N(C(=O)O)C4=O)cc3)cc2)SC1=S,CO,478.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccc(/C=C4/SC(=S)N(CC(=O)O)C4=O)cc3)cc2)SC1=S,ClC(Cl)Cl,497.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccc(/C=N/N(c4ccccc4)c4ccccc4)cc3)cc2)SC1=S,ClC(Cl)Cl,487.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CC#N,468.0
O=C(O)CN1C(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CCO,458.0
O=C(O)CN1C(=O)/C(=C/c2ccc3c(c2)C2CCCC2N3c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)SC1=S,C1CCOC1,494.0
O=C(O)CN1C(=O)/C(=C/c2ccc3c(c2)C2CCCC2N3c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)SC1=S,ClC(Cl)Cl,514.0
O=C(O)CN1C(=O)/C(=C/c2ccc3c(c2)CC(O)CN3c2ccccc2)SC1=S,C1CCOC1,473.0
O=C(O)CN1C(=O)/C(=C/c2ccc3c(c2)c2ccccc2n3-c2ccccc2)SC1=S,CC#N,437.0
O=C(O)CN1C(=O)/C(=C\C=C(/Cl)c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CC#N,488.0
O=C(O)CN1C(=O)/C(=C\C=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CO,476.0
O=C(O)CN1C(=O)/C(=C\c2cc(Br)c(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2Br)SC1=S,ClCCl,478.0
O=C(O)CN1C(=O)/C(=C\c2cc(Cl)c(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2Cl)SC1=S,ClCCl,480.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(-c4cc5ccc(B(O)O)c6ccc7cccc4c7c56)c4nsnc34)o2)SC1=S,C1CCOC1,394.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(-c4cc5ccc(B(O)O)c6ccc7cccc4c7c56)c4nsnc34)o2)SC1=S,CCO,394.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(B(O)O)s6)s5)s4)c4nsnc34)o2)SC1=S,C1CCOC1,444.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(B(O)O)s6)s5)s4)c4nsnc34)o2)SC1=S,CCO,444.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(-c4ccc5c(B(O)O)c6ccccc6cc5c4)c4nsnc34)o2)SC1=S,C1CCOC1,419.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(-c4ccc5c(B(O)O)c6ccccc6cc5c4)c4nsnc34)o2)SC1=S,CCO,419.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)SC1=S,CC#N,476.0
O=C(O)CN1C(=O)/C(=C\c2ccc(-c3ccc4c(c3)C3CCCC3N4c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)s2)SC1=S,ClC(Cl)Cl,548.0
O=C(O)CN1C(=O)/C(=C\c2ccc(/C=C/c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)SC1=S,ClCCl,468.0
O=C(O)CN1C(=O)/C(=C\c2ccc(N(c3ccc(-c4ccc5c(c4)[nH]c4ccccc45)cc3)c3ccc(-c4ccc5c(c4)[nH]c4ccccc45)cc3)cc2)SC1=S,CCO,477.0
O=C(O)CN1C(=O)/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CCO,455.0
O=C(O)CN1C(=O)/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CO,458.0
O=C(O)CN1C(=O)/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,ClCCl,485.0
O=C(O)CN1C(=O)/C(=c2/s/c(=C\C=C3Sc4ccccc4N3CCCS(=O)(=O)O)c(=O)n2CC(=O)O)SC1=S,CCO,500.0
O=C(O)CN1C(=O)C(=CC=Cc2ccc(N(c3ccccc3)c3ccc(/C=C/C=C4/SC(=S)N(C(=O)O)C4=O)cc3)cc2)SC1=S,CO,501.0
O=C(O)CN1C(=O)C(=Cc2cc(-c3ccc(-c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)on2)SC1=S,CN(C)C=O,414.0
O=C(O)CN1C(=O)C(=Cc2ccc(-c3ccc(N(c4ccc(-c5ccc(C=C6SC(=S)N(CC(=O)O)C6=O)s5)cc4)c4ccc(-c5ccc(C=C6SC(=S)N(CC(=O)O)C6=O)s5)cc4)cc3)s2)SC1=S,CN(C)C=O,510.0
O=C(O)CN1C(=O)C(=Cc2ccc(-c3ccc4ccc5cccc6ccc3c4c56)s2)SC1=S,C1CCOC1,444.0
O=C(O)CN1C(=O)C(=Cc2ccc(-c3nc(Cl)nc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)n3)cc2)SC1=S,CN(C)C=O,396.0
O=C(O)CN1C(=O)C(=Cc2ccc(N(N=Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)c3ccccc3)cc2)SC1=S,ClC(Cl)Cl,488.0
O=C(O)CN1C(=O)C(=Cc2ccc(N(c3ccc(C=C4SC(=S)N(CC(=O)O)C4=O)cc3)c3ccc(-c4ccc5c(c4)[nH]c4ccccc45)cc3)cc2)SC1=S,CCO,491.0
O=C(O)CN1C(=O)C(=Cc2ccc(N(c3ccccc3)c3ccc(-c4ccc5c(c4)[nH]c4ccccc45)cc3)cc2)SC1=S,CCO,470.0
O=C(O)CN1C(=O)C(=Cc2ccc(N(c3ccccc3)c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)cc2)SC1=S,CN(C)C=O,467.0
O=C(O)CN1C(=O)C(=Cc2ccc(N(c3ccccc3)c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)cc2)SC1=S,CO,468.0
O=C(O)CN1C(=O)C(=Cc2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CCO,458.0
O=C(O)CN1C(=O)C(=Cc2ccc(NC3=CCC(C=C4SC(=S)N(CC(=O)O)C4=O)(c4ccccc4)C=C3)cc2)SC1=S,CCO,467.0
O=C(O)CN1C(=O)C(=Cc2ccc(Nc3ccc(-c4ccccc4)cc3)cc2)SC1=S,CCO,455.0
O=C(O)CN1C(=O)C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)SC1=S,CC#N,459.0
O=C(O)COc1cccc(-c2c3nc(cc4ccc([nH]4)c(-c4cccc(OCC(=O)O)c4)c4nc(cc5ccc2[nH]5)C=C4)C=C3)c1,CS(C)=O,630.0
O=C(O)COc1cccc(-c2c3nc(cc4ccc([nH]4)c(-c4cccc(OCC(=O)O)c4)c4nc(cc5ccc2[nH]5)CC4)CC3)c1,CS(C)=O,736.0
O=C(O)COc1cccc(OCC(=O)O)c1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,CCO,557.0
O=C(O)COc1cccc(OCC(=O)O)c1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,O,567.0
O=C(O)C[n+]1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,483.0
O=C(O)Cc1ccc(-c2c3nc(c(-c4ccc(CC(=O)O)cc4)c4ccc([nH]4)c(-c4ccccc4O)c4nc(c(-c5ccc(CC(=O)O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,CS(C)=O,648.6
O=C(O)Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,329.0
O=C(O)Cc1ccccc1F,CS(C)=O,357.0
O=C(O)Cn1c(=O)sc(=Cc2ccc3c(c2)C2CCCC2N3c2ccc(C=C(c3ccccc3)c3ccccc3)cc2)/c1=c1/s/c(=C2/SC(=S)N(c3ccccc3)C2=O)n(-c2ccccc2)c1=O,ClC(Cl)Cl,571.0
O=C(O)Cn1c2ccccc2c(=O)c2ccccc21,O,409.0
O=C(O)[C@@H]1C=CN2C(=C1)C1=C[C@H](C(=O)O)C=CN1[Ru]21(N=C=S)(N=C=S)N2C=C[C@@H](C(=O)O)C=C2C2=C[C@H](C(=O)O)C=CN21,CN(C)C=O,530.7142857142857
O=C(O)[C@@H]1C=CN2C(=C1)C1=C[C@H](C(=O)O)C=CN1[Ru]21(N=C=S)(N=C=S)N2C=C[C@@H](C(=O)O)C=C2C2=C[C@H](C(=O)O)C=CN21,CS(C)=O,515.0
O=C(O)c1c2ccccc2c(C(=O)O)c2ccccc12,C1CCOC1,387.0
O=C(O)c1c2ccccc2c(C(=O)O)c2ccccc12,CN(C)C=O,389.0
O=C(O)c1c2ccccc2nc2ccccc12,C1CCOC1,360.0
O=C(O)c1c2ccccc2nc2ccccc12,C1COCCO1,362.0
O=C(O)c1c2ccccc2nc2ccccc12,CC#N,354.0
O=C(O)c1c2ccccc2nc2ccccc12,CCCCCO,370.0
O=C(O)c1c2ccccc2nc2ccccc12,CCCCO,370.0
O=C(O)c1c2ccccc2nc2ccccc12,CCCO,368.0
O=C(O)c1c2ccccc2nc2ccccc12,CCO,369.0
O=C(O)c1c2ccccc2nc2ccccc12,CO,356.0
O=C(O)c1c2ccccc2nc2ccccc12,COCCOC,360.0
O=C(O)c1c2ccccc2nc2ccccc12,ClC(Cl)Cl,362.0
O=C(O)c1c2ccccc2nc2ccccc12,ClCCl,362.0
O=C(O)c1c2ccccc2nc2ccccc12,OCCO,356.0
O=C(O)c1cc(-c2ccccc2)nc2ccccc12,CCO,365.0
O=C(O)c1cc(=O)c2ccccc2[nH]1,O,332.0
O=C(O)c1cc(C(=O)O)cc(-c2nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)n2)c1,CN(C)C=O,451.0
O=C(O)c1cc(CBr)ccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12,O,492.0
O=C(O)c1cc(CCl)ccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12,O,491.0
O=C(O)c1cc(N2C(=O)C=CC2=O)ccc1-c1c2cc(Br)c(=O)c(Br)c-2oc2c(Br)c(O)c(Br)cc12,CO,524.0
O=C(O)c1cc(N=C=S)ccc1-c1c2cc(Br)c(=O)c(Br)c-2oc2c(Br)c(O)c(Br)cc12,O,521.0
O=C(O)c1cc(Nc2nc(Cl)nc(Cl)n2)ccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12,O,492.0
O=C(O)c1cc(O)c(O)c(O)c1,O,258.0
O=C(O)c1cc([N+](=O)[O-])c(N=Nc2c(O)ccc3ccccc23)c([N+](=O)[O-])c1,CCOC(C)=O,470.0
O=C(O)c1cc([N+](=O)[O-])c(NOC(c2ccccc2)(c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1,CO,405.0
O=C(O)c1cc2c(cc1C(=O)O)C(=O)C(=Cc1ccc(N(c3ccccc3)c3ccccc3)cc1)C2=O,C1CCOC1,495.0
O=C(O)c1cc2c(cc3ccc4cccc5ccc2c3c45)[nH]1,CCOC(C)=O,398.0
O=C(O)c1cc2c(ccc3ccccc32)oc1=O,C1COCCO1,372.0
O=C(O)c1cc2c(ccc3ccccc32)oc1=O,CC#N,376.0
O=C(O)c1cc2c(ccc3ccccc32)oc1=O,CCCCO,372.0
O=C(O)c1cc2c(ccc3ccccc32)oc1=O,CCO,363.0
O=C(O)c1cc2c(ccc3ccccc32)oc1=O,CO,364.0
O=C(O)c1cc2c(ccc3ccccc32)oc1=O,O,376.0
O=C(O)c1cc2ccc(O)cc2oc1=O,CC#N,386.0
O=C(O)c1ccc(-c2c3cc4c5c(c3[o+]c3c6c7c(cc23)CCCN7CCC6)CCCN5CCC4)c(C(=O)O)c1,CCO,572.0
O=C(O)c1ccc(-c2c3cc4c5c(c3oc3c2ccc2cc(=O)ccc23)CCCN5CCC4)c(C(=O)O)c1,O,678.0
O=C(O)c1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1,O,493.0
O=C(O)c1ccc(-c2c3ccc4cc(O)ccc4c3oc3c2ccc2cc(=O)ccc23)c(C(=O)O)c1,O,599.0
O=C(O)c1ccc(-c2c3nc(c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4ccc([nH]4)c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4nc(c(-c5ccc(C(=O)O)cc5)c5ccc2s5)C=C4)C=C3)cc1,C1CCOC1,429.0
O=C(O)c1ccc(-c2ccc(C#C[Ru]34(C#Cc5ccc(-n6c7ccccc7c7ccccc76)cc5)([PH](c5ccccc5)(c5ccccc5)CC[PH]3(c3ccccc3)c3ccccc3)[PH](c3ccccc3)(c3ccccc3)CC[PH]4(c3ccccc3)c3ccccc3)c3nsnc23)cc1,ClCCl,545.0
O=C(O)c1ccc(-c2cnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)cc1,CO,387.0
O=C(O)c1ccc(-c2nc(-c3ccc(/C=C/c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)nc(-c3ccc(/C=C/c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)n2)cc1,CN(C)C=O,465.0
O=C(O)c1ccc(-c2nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)nc(-c3ccc(/C=C/c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)n2)cc1,CN(C)C=O,451.0
O=C(O)c1ccc(-c2nc(-c3ccccc3)c3c4ccccc4ccn23)cc1,CC#N,353.0
O=C(O)c1ccc(-c2nc(-c3ccccc3)c3ccccn23)cc1,CC#N,372.0
O=C(O)c1ccc(-c2nnc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)o2)cc1,CCO,364.0
O=C(O)c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2ccc(C(=O)O)cc2)cc1,CCO,425.0
O=C(O)c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(C(=O)O)cc2)=C2/C=CC(=N2)/C=4c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,599.0
O=C(O)c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=C2/C=CC(=N2)/C=4c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,605.0
O=C(O)c1ccc(/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(c3ccccc3)=C3/C=CC2=N3)/C(c2ccccc2)=C2/C=CC(=N2)/C=4c2ccccc2)cc1,C1CCOC1,595.0
O=C(O)c1ccc(/C=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,385.0
O=C(O)c1ccc(/N=C/C=C(\Cl)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1O,CC#N,369.0
O=C(O)c1ccc(C#C/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c([nH]3)=C/C3C=C/C(=C(\c4ccccc4)c4ccc2[nH]4)N3)cc1,C1CCOC1,431.0
O=C(O)c1ccc(C#C/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccccc2)=C2/C=CC(=N2)/C=4N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,445.0
O=C(O)c1ccc(C#C/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccccc2)=C2/C=CC(=N2)/C=4N(c2ccccc2)c2ccccc2)cc1O,C1CCOC1,448.0
O=C(O)c1ccc(C#C/C2=c3\cc/c4n3[Zn]n3c(ccc3/C(N(c3ccccc3)c3ccccc3)=C3/C=CC(=N3)/C=4c3ccccc3)/C(c3ccccc3)=C3/C=CC2=N3)cc1,C1CCOC1,640.0
O=C(O)c1ccc(C#CC2=CC3=N/C2=C(/c2ccccc2)c2ccc4n2[Zn]n2/c(cc/c2=C/3c2ccccc2)=C(/c2ccccc2)C2=N/C(=C\4c3ccccc3)C=C2)cc1,ClCCl,604.0
O=C(O)c1ccc(C#CC2=c3ccc4n3[Zn]35n6c2ccc6C(c2ccc(N(c6ccccc6)c6ccccc6)cc2)=c2ccc(n23)=C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)c2ccc(n25)C=4c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,450.0
O=C(O)c1ccc(C(=O)O)c(-c2c3cc(Cl)c(=O)cc-3oc3cc(O)c(Cl)cc23)c1,O,504.0
O=C(O)c1ccc(C(=O)O)c2cc3ccccc3cc12,C1CCOC1,396.0
O=C(O)c1ccc(C(=O)O)c2cc3ccccc3cc12,CN(C)C=O,390.0
O=C(O)c1ccc(C2=C(/C=C/c3[se]c4ccccc4[n+]3CCCCS(=O)(=O)[O-])CCC/C2=C\C=C2/[Se]c3ccccc3N2CCCCS(=O)(=O)[O-])cc1,CO,800.0
O=C(O)c1ccc(C2=c3cc4c5c(c3Oc3c2ccc2cc(O)ccc32)CCC[N+]=5CCC4)c(C(=O)O)c1,O,569.0
O=C(O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)cc1,C1CCCCC1,376.0
O=C(O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)cc1,C1CCOC1,366.0
O=C(O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)cc1,C1COCCO1,377.0
O=C(O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)cc1,CC#N,382.0
O=C(O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)cc1,CCCCCCC,375.0
O=C(O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)cc1,CO,389.0
O=C(O)c1ccc(C2CC(c3cccc4ccccc34)=NN2c2ccccc2)cc1,O,383.0
O=C(O)c1ccc(C2N=C3Oc4c(cc5c6c4CCCN6CCC5)C=C3c3nc4ccccc4n32)cc1,CS(C)=O,475.0
O=C(O)c1ccc(N=CC=C(Cl)c2ccc3c(c2)c2cc(C(Cl)=CC=Nc4ccc(C(=O)O)c(O)c4)ccc2n3-c2ccccc2)cc1O,CN(C)C=O,430.0
O=C(O)c1ccc(N=CC=C(Cl)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1O,CN(C)C=O,416.0
O=C(O)c1ccc(N=NC2=CC=C3N=[N+](c4ccc(C(=O)O)cc4)[B-](F)(F)C23)cc1,C1CCOC1,439.0
O=C(O)c1ccc(N=Nc2ccc(O)c3ncccc23)cc1,CS(C)=O,413.0
O=C(O)c1ccc(NC(=O)C(Cc2ccc(O)cc2)NC(=O)c2ccccc2)cc1,ClC(Cl)Cl,672.0
O=C(O)c1ccc(Nc2ccc(O)c3c2C(=O)c2c(O)ccc(Nc4ccc(N(c5ccccc5)c5ccccc5)cc4)c2C3=O)cc1,CO,667.0
O=C(O)c1ccc2c(c1)/N=C/c1cc(N(c3ccccc3)c3ccccc3)ccc1O[Zn]Oc1ccc(N(c3ccccc3)c3ccccc3)cc1/C=N/2,C1CCOC1,470.0
O=C(O)c1ccc2c(c1)C(=O)/C(=C/c1ccc3c(c1)Sc1ccccc1N3CCCCCCCCCCN1c3ccccc3Sc3cc(/C=C4\C(=O)c5ccc(C(=O)O)cc5C4=O)ccc31)C2=O,CN(C)C=O,508.0
O=C(O)c1ccc2c(c1)nc1c3cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc(c(=O)n21)c43,C1CCOC1,460.0
O=C(O)c1ccc2c(c1)nc1c3cccc4c(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc(c(=O)n21)c43,Cc1ccccc1,460.0
O=C(O)c1ccc2c3ccc(C(=O)O)c4c(C(=O)O)ccc(c5ccc(C(=O)O)c1c25)c43,CCO,480.0
O=C(O)c1ccc2cc3cc(C(=O)O)ccc3cc2c1,C1CCOC1,409.0
O=C(O)c1ccc2cc3cc(C(=O)O)ccc3cc2c1,CN(C)C=O,409.0
O=C(O)c1ccc2ccc3cccc4ccc1c2c34,C1CCOC1,379.0
O=C(O)c1ccc2ccc3cccc4ccc1c2c34,CC#N,379.0
O=C(O)c1ccc2ccc3cccc4ccc1c2c34,CCCCCC,381.0
O=C(O)c1ccc2ccc3cccc4ccc1c2c34,CCO,340.0
O=C(O)c1ccc2ccc3cccc4ccc1c2c34,CN(C)C=O,377.0
O=C(O)c1ccc2ccc3cccc4ccc1c2c34,CO,339.0
O=C(O)c1ccc2ccc3cccc4ccc1c2c34,ClCCl,382.0
O=C(O)c1ccc2nc(-c3ccc(C=Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)c(-c3ccc(C=Cc4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)nc2c1,ClC(Cl)Cl,400.0
O=C(O)c1ccc2nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)[nH]c2c1,CN(C)C=O,362.0
O=C(O)c1cccc(/C2=C3\C=CC(=N3)/C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=C2/C=CC(=N2)/C=4c2cccc(C(O)O)c2)c1,C1CCOC1,602.0
O=C(O)c1cccc(/C2=C3\C=CC(=N3)/C(c3ccc(N(c4ccccc4)c4ccccc4)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cccc(C(=O)O)c2)=C2/C=CC(=N2)/C=4c2cccc(C(=O)O)c2)c1,C1CCOC1,599.0
O=C(O)c1cccc2c(=O)c3ccccc3[nH]c12,O,413.0
O=C(O)c1ccccc1,O,266.0
O=C(O)c1ccccc1-c1c2cc(F)c(=O)cc-2oc2cc(O)c(F)cc12,O,490.0
O=C(O)c1ccccc1-c1c2ccc(=O)cc-2oc2cc(O)ccc12,O,490.0
O=C(O)c1ccccc1-c1nc(-c2ccccc2)c2ccccn12,CC#N,357.0
O=C(O)c1ccccc1C(=O)c1c2c(n3ccc(-c4ccncc4)cc13)C(=O)c1ccccc1C2=O,CCO,479.0
O=C(O)c1ccccc1C1=c2cc3c4c(c2Oc2c1c(=O)oc1cc(N(c5ccccc5)c5ccccc5)ccc21)CCC[N+]=4CCC3,ClC(Cl)Cl,614.0
O=C(O)c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,CC#N,560.0
O=C(O)c1ccccc1N=Nc1nc2ccc([N+](=O)[O-])cc2s1,CO,347.0
O=C(O)c1ccccc1Nc1cccc(C(F)(F)F)c1,C1COCCO1,350.0
O=C(O)c1ccccc1Nc1cccc(C(F)(F)F)c1,ClC(Cl)Cl,353.0
O=C(O)c1ccccc1Nc1ccccc1,C1CCOC1,353.0
O=C(O)c1ccccc1Nc1ccccc1,C1COCCO1,353.0
O=C(O)c1ccccc1Nc1ccccc1,CC#N,350.0
O=C(O)c1ccccc1Nc1ccccc1,CCOC(C)=O,356.0
O=C(O)c1ccccc1Nc1ccccc1,CN(C)C=O,341.0
O=C(O)c1ccccc1Nc1ccccc1,ClC(Cl)Cl,357.0
O=C(O)c1ccnc(N=Cc2cc(N=Nc3ccc([N+](=O)[O-])cc3)ccc2O)c1,O,448.0
O=C(OC1=CC=CC(=COc2ccc(C=Cc3ccc([N+](=O)[O-])cc3)cc2)C1)c1ccc(C(=O)c2ccccc2)cc1,C1CCOC1,374.0
O=C(OCCCCCCO)c1ccc2c(c1)c1cccc3cnc2n31,CO,420.0
O=C(ON1C(=O)C=CC1=O)c1cc(Cl)c(C(=O)O)c(-c2c3cc(Cl)c(=O)c(Cl)c-3oc3c(Cl)c(O)c(Cl)cc23)c1Cl,O,533.0
O=C(ON1C(=O)C=CC1=O)c1cc(Cl)c(C(=O)O)c(-c2c3cc(Cl)c(=O)cc-3oc3cc(O)c(Cl)cc23)c1Cl,O,521.0
O=C(ON1C(=O)CCC1=O)c1cc(Cl)c(C(=O)O)c(-c2c3cc(Cl)c(=O)cc-3oc3cc(O)c(Cl)cc23)c1Cl,O,521.0
O=C([O-])COc1cc(NC(=O)c2ccc(-c3c4cc(Cl)c(=O)cc-4oc4cc(O)c(Cl)cc34)c(C(=O)[O-])c2)ccc1N(CC(=O)[O-])CC(=O)[O-],O,506.0
O=C([O-])Cc1ccccc1-c1ccccc1,CCOC(C)=O,371.0
O=C([O-])c1c(Cl)c(Cl)c(Cl)c(Cl)c1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,CC(C)O,561.0
O=C([O-])c1c(Cl)c(Cl)c(Cl)c(Cl)c1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,CCO,558.0
O=C([O-])c1c(Cl)c(Cl)c(Cl)c(Cl)c1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,CO,556.0
O=C([O-])c1c(Cl)c(Cl)c(Cl)c(Cl)c1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,O,548.0
O=C([O-])c1c2ccccc2c(C(=O)[O-])c2ccccc12,CN(C)C=O,400.0
O=C([O-])c1cc(N2C(=O)C=CC2=O)ccc1-c1c2cc(F)c(=O)cc-2oc2cc([O-])c(F)cc12,O,493.0
O=C([O-])c1cc2c(ccc3ccccc32)oc1=O,O,360.0
O=C([O-])c1ccc(C(=O)[O-])c(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)c1,CCO,571.0
O=C([O-])c1ccc(C(=O)[O-])c(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)c1,O,574.0
O=C([O-])c1ccc(C(=O)[O-])c2cc3ccccc3cc12,CN(C)C=O,396.0
O=C([O-])c1ccc(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)c(C(=O)O)c1,CCO,578.0
O=C([O-])c1ccc(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)c(C(=O)[O-])c1,CCO,573.0
O=C([O-])c1ccc(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)c(C(=O)[O-])c1,O,574.0
O=C([O-])c1ccccc1,CCO,634.0
O=C([O-])c1ccccc1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,CC(C)O,532.0
O=C([O-])c1ccccc1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,CCO,532.0
O=C([O-])c1ccccc1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,CO,526.0
O=C([O-])c1ccccc1-c1c2cc(I)c(=O)c(I)c-2oc2c(I)c([O-])c(I)cc12,O,521.0
O=C([O-])c1ccccc1-c1c2cc3c4c(c2[o+]c2c5c6c(cc12)CCCN6CCC5)CCCN4CCC3,CS(C)=O,586.0
O=C([O-])c1ccccc1-c1c2ccc(=[N+]3CCC3)cc-2oc2cc(N3CCC3)ccc12,O,549.0
O=C([O-])c1ccccc1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,O,560.0
O=C([O-])c1ccccc1-c1c2ccc(=[N+]3CCCCCC3)cc-2oc2cc(N3CCCCCC3)ccc12,O,560.0
O=C([O-])c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,CC#N,577.0
O=C([O-])c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,CCO,564.0
O=C([O-])c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,CN(C)C=O,580.0
O=C([O-])c1ccccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,O,577.5
O=C([O-])c1ccccc1O,CO,297.0
O=C([O-])c1ccccc1O,O,296.0
O=C(c1cc(F)c(F)cc1F)c1cc(F)c(N2CCCCC2)cc1F,CCO,350.0
O=C(c1cc(F)c(N2CCCCC2)cc1F)c1cc(F)c(N2CCCCC2)cc1F,CCO,354.0
O=C(c1cc(F)c(N2CCOCC2)cc1F)c1cc(F)c(N2CCOCC2)cc1F,CCO,342.0
O=C(c1cc(F)c(O)cc1F)c1cc(F)c(O)cc1F,CCO,306.0
O=C(c1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1)c1ccc(-n2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc32)cc1,Cc1ccccc1,370.0
O=C(c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1)c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cn1,Cc1ccccc1,345.0
O=C(c1ccc(/C(=C(/c2ccccc2)c2ccc(C(=O)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)c2ccccc2)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,340.0
O=C(c1ccc(Br)cc1)c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1,C1CCOC1,365.0
O=C(c1ccc(C(=C(c2ccc(C(=O)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)c2ccc(C(=O)c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)c2ccccc2)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,340.0
O=C(c1ccc(C(=C(c2ccccc2)c2ccccc2)c2ccccc2)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,340.0
O=C(c1ccc(C(=O)c2ccc(N3c4ccccc4Oc4ccccc43)cc2)cc1)c1ccc(N2c3ccccc3Oc3ccccc32)cc1,Cc1ccccc1,425.0
O=C(c1ccc(Cl)cc1)c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1,C1CCOC1,357.0
O=C(c1ccc(F)cc1)c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1,C1CCOC1,365.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccc(F)cc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,C1CCOC1,370.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccc(F)cc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CC#N,364.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccc(F)cc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CCO,368.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccc(F)cc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CCOC(C)=O,366.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccc(F)cc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CN(C)C=O,364.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccc(F)cc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,ClCCl,374.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccc(F)cc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,c1ccccc1,376.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccccc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,C1CCOC1,368.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccccc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CC#N,364.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccccc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CCO,368.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccccc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CCOC(C)=O,366.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccccc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CN(C)C=O,358.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccccc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,ClCCl,372.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2ccccc2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,c1ccccc1,372.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2cccs2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,C1CCOC1,370.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2cccs2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CC#N,364.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2cccs2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CCO,368.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2cccs2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CCOC(C)=O,366.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2cccs2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,CN(C)C=O,358.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2cccs2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,ClCCl,374.0
O=C(c1ccc(N(c2ccccc2)c2ccccc2)cc1)[C@H]1[C@H](c2cccs2)C[C@](O)(c2ccccn2)C[C@]1(O)c1ccccn1,c1ccccc1,372.0
O=C(c1ccc(N2c3ccccc3Oc3ccccc32)cc1)c1ccc(N2c3ccccc3Oc3ccccc32)cc1,Cc1ccccc1,413.0
O=C(c1ccc(N2c3ccccc3Oc3ccccc32)cc1)c1ccc2sc3ccccc3c2c1,C1CCOC1,312.0
O=C(c1ccc(N2c3ccccc3Oc3ccccc32)cc1)c1cccc(C(=O)c2ccc(N3c4ccccc4Oc4ccccc43)cc2)c1,Cc1ccccc1,416.0
O=C(c1ccc(N2c3ccccc3Sc3ccccc32)cc1)c1ccc2sc3ccccc3c2c1,C1CCOC1,330.0
O=C(c1ccc(N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3ccccc32)cc1)c1ccc(N2c3ccccc3[Si](c3ccccc3)(c3ccccc3)c3ccccc32)cc1,Cc1ccccc1,337.0
O=C(c1ccc2c3c(cccc13)-c1cccc3c1C2CC=C3)c1c(CCc2ccccc2)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,470.0
O=C(c1ccc2c3c(cccc13)-c1cccc3c1C2CC=C3)c1c(Cc2ccccc2)c2ccc3cccc4c5cccc6ccc1c(c65)c2c34,ClCCl,467.0
O=C(c1ccccc1)c1cc2ccc1CCc1ccc(c(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c1)CC2,Cc1ccccc1,312.0
O=C(c1ccccc1)c1cc2ccc1CCc1ccc(cc1-c1ccc(N(c3ccccc3)c3ccccc3)cc1)CC2,Cc1ccccc1,311.0
O=C(c1ccccc1)c1ccc(-n2c3ccccc3c3c2c2ccccc2n3-c2ccccc2)cc1,Cc1ccccc1,358.0
O=C(c1ccccc1)c1ccc(-n2ncc(-c3ccccc3)n2)cc1,CO,317.0
O=C(c1ccccc1)c1ccc2oc3ccccc3c(=O)c2c1,CC#N,315.0
O=C(c1ccccc1)c1cnn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)n1,C1CCOC1,368.0
O=C(c1ccccc1)c1nn(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)nc1-c1ccccc1,C1CCOC1,341.0
O=C(c1ccccc1)c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,362.0
O=C(c1ccccc1F)c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1,C1CCOC1,369.0
O=C(c1ccncc1)c1cc(-n2c3ccccc3c3ccccc32)ccc1-n1c2ccccc2c2ccccc21,Cc1ccccc1,400.0
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1,C1CCOC1,342.6395939
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1,CCCCCC,342.6395939
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1,Cc1ccccc1,362.0
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1,ClCCl,342.6395939
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCOC1,353.1531532
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,CCCCCC,354.954955
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,Cc1ccccc1,359.0
O=C(c1ccncc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,359.2342342
O=C(c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1)c1c(F)c(F)c(F)c(F)c1F,C1CCOC1,368.0
O=C(c1nn(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)nc1-c1ccccc1)c1c(F)cccc1F,C1CCOC1,370.0
O=C(c1sc(-c2ccc(-c3cc(-c4cccs4)c(C(=O)N4CCOCC4)s3)s2)cc1-c1cccs1)N1CCOCC1,ClCCl,379.0
O=C1/C(=C2\Nc3cc4ccc5cccc6ccc(c3C2=O)c4c56)Nc2cc3ccc4cccc5ccc(c21)c3c45,C1CCOC1,687.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)Cl)cc3C2=O)Sc2ccc(S(=O)(=O)Cl)cc21,C1COCCO1,526.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)Cl)cc3C2=O)Sc2ccc(S(=O)(=O)Cl)cc21,CS(C)=O,553.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)Nc4ccccc4)cc3C2=O)Sc2ccc(S(=O)(=O)Nc3ccccc3)cc21,C1COCCO1,534.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)Nc4ccccc4)cc3C2=O)Sc2ccc(S(=O)(=O)Nc3ccccc3)cc21,CN(C)C=O,542.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)Nc4ccccc4)cc3C2=O)Sc2ccc(S(=O)(=O)Nc3ccccc3)cc21,CO,536.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)Nc4ccccc4)cc3C2=O)Sc2ccc(S(=O)(=O)Nc3ccccc3)cc21,CS(C)=O,546.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)O)cc3C2=O)Sc2ccc(S(=O)(=O)O)cc21,C1COCCO1,530.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)O)cc3C2=O)Sc2ccc(S(=O)(=O)O)cc21,CN(C)C=O,551.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)O)cc3C2=O)Sc2ccc(S(=O)(=O)O)cc21,CO,553.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)O)cc3C2=O)Sc2ccc(S(=O)(=O)O)cc21,CS(C)=O,553.0
O=C1/C(=C2\Sc3ccc(S(=O)(=O)O)cc3C2=O)Sc2ccc(S(=O)(=O)O)cc21,O,546.0
O=C1/C(=C2\Sc3ccccc3C2=O)Sc2ccccc21,C1COCCO1,536.0
O=C1/C(=C2\Sc3ccccc3C2=O)Sc2ccccc21,CN(C)C=O,543.0
O=C1/C(=C2\Sc3ccccc3C2=O)Sc2ccccc21,CO,538.0
O=C1/C(=C2\Sc3ccccc3C2=O)Sc2ccccc21,CS(C)=O,545.0
O=C1/C(=C2\Sc3ccccc3C2=O)Sc2ccccc21,c1ccccc1,544.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,C1CCOC1,473.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,C1COCCO1,475.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,CC#N,475.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,CC(C)=O,472.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,CCOC(C)=O,471.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,CN(C)C=O,478.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,CO,477.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,CS(C)=O,482.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,Cc1ccccc1,485.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,ClC(Cl)Cl,491.0
O=C1/C(=C\c2ccc(N(c3ccccc3)c3ccccc3)cc2)S(=O)(=O)c2ccccc21,ClCCl,485.0
O=C1C(=C(O)C=Cc2cc3c4c(c2)CCCN4CCC3)C(=O)c2ccccc21,C1CCOC1,540.0
O=C1C(=CC=C2C=C(c3ccccc3)C=C(c3ccccc3)O2)C(=O)c2ccccc21,ClCCl,574.0
O=C1C(=CC=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)C(=O)c2ccccc21,ClCCl,528.0
O=C1C(=CC=C2C=C(c3ccccc3)SC(c3ccccc3)=C2)C(=O)c2ccccc21,ClCCl,556.0
O=C1C(=CC=CC=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)C(=O)c2cscc21,ClCCl,613.0
O=C1C(=Cc2cc3c4c(c2)CCCN4CCC3)Oc2ccccc21,CO,503.0
O=C1C(=Cc2cc3c4c(c2O)CCCN4CCC3)Oc2ccccc21,CO,518.0
O=C1C(=O)c2ccccc2-c2ccccc21,CC#N,554.0
O=C1C(=c2c(=O)c3c4ccccc4cc4cc5ccccc5c2c43)C(=O)c2ccccc21,ClCCl,518.5639229
O=C1C(Cl)=C(NCc2ccccc2)C(=O)C(Cl)=C1NCc1ccccc1,ClC(Cl)Cl,539.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2ccc(N3CCOCC3)c3cccc1c23,C1CCOC1,464.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2ccc(N3CCOCC3)c3cccc1c23,CC#N,468.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2ccc(N3CCOCC3)c3cccc1c23,CCO,460.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2ccc(N3CCOCC3)c3cccc1c23,CO,461.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2ccc(N3CCOCC3)c3cccc1c23,ClCCl,468.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2cccc3c(N4CCOCC4)ccc1c23,C1CCOC1,427.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2cccc3c(N4CCOCC4)ccc1c23,CC#N,424.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2cccc3c(N4CCOCC4)ccc1c23,CCO,423.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2cccc3c(N4CCOCC4)ccc1c23,CO,419.0
O=C1C2=C(O[B-](F)(F)[n+]3c2ccc2ccccc23)c2cccc3c(N4CCOCC4)ccc1c23,ClCCl,427.0
O=C1C2=C3c4ccsc4C=CN3C(=O)C2=C2c3ccsc3C=CN12,CN(C)C=O,575.0
O=C1C2=C3c4ccsc4C=CN3C(=O)C2=C2c3ccsc3C=CN12,ClC(Cl)Cl,575.0
O=C1C=C(NC(=O)c2ccccc2)c2ccccc2C1=O,CCO,278.0
O=C1C=C(NC(=O)c2cccnc2)c2ccccc2C1=O,CCO,268.0
O=C1C=C(Nc2ccc(F)c(F)c2)C(=O)c2ccccc21,CO,454.0
O=C1C=C(Nc2ccc(F)cc2)C(=O)c2ccccc21,CCCCCC,445.0
O=C1C=C(Nc2ccc(F)cc2)C(=O)c2ccccc21,CO,461.0
O=C1C=C(Nc2ccc(F)cc2F)C(=O)c2ccccc21,CCCCCC,439.0
O=C1C=C(Nc2ccc(F)cc2F)C(=O)c2ccccc21,CO,443.0
O=C1C=C(Nc2ccc(F)cc2[N+](=O)[O-])C(=O)c2ccccc21,CO,448.0
O=C1C=C(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C(=O)c2ccccc21,CO,437.0
O=C1C=C(Nc2cccc(F)c2)C(=O)c2ccccc21,CCCCCC,440.0
O=C1C=C(Nc2cccc(F)c2)C(=O)c2ccccc21,CO,459.0
O=C1C=C(Nc2ccccc2)C(=O)c2ccccc21,CCCCCC,450.0
O=C1C=C(Nc2ccccc2)C(=O)c2ccccc21,CO,466.0
O=C1C=C(Nc2ccccc2)CCC1,C1CCCCC1,295.0
O=C1C=C(Nc2ccccc2)CCC1,C1CCOC1,302.0
O=C1C=C(Nc2ccccc2)CCC1,C1COCCO1,302.0
O=C1C=C(Nc2ccccc2)CCC1,CC#N,307.0
O=C1C=C(Nc2ccccc2)CCC1,CC(C)O,307.0
O=C1C=C(Nc2ccccc2)CCC1,CC1CCCCC1,295.0
O=C1C=C(Nc2ccccc2)CCC1,CCO,307.0
O=C1C=C(Nc2ccccc2)CCC1,CCOC(C)=O,301.0
O=C1C=C(Nc2ccccc2)CCC1,CCOCC,296.0
O=C1C=C(Nc2ccccc2)CCC1,CN(C)C=O,306.0
O=C1C=C(Nc2ccccc2)CCC1,CO,305.0
O=C1C=C(Nc2ccccc2)CCC1,CS(C)=O,307.0
O=C1C=C(Nc2ccccc2)CCC1,ClC(Cl)(Cl)Cl,299.0
O=C1C=C(Nc2ccccc2)CCC1,ClC(Cl)Cl,303.0
O=C1C=C(Nc2ccccc2)CCC1,O,306.0
O=C1C=C(Nc2ccccc2F)C(=O)c2ccccc21,CCCCCC,442.0
O=C1C=C(Nc2ccccc2F)C(=O)c2ccccc21,CO,448.0
O=C1C=C(Nc2ccccc2[N+](=O)[O-])C(=O)c2ccccc21,CO,450.0
O=C1C=CC(=CC=C2C=C(c3ccccc3)OC(c3ccccc3)=C2)c2cccnc21,CC#N,545.0
O=C1C=CC(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=C/C1=C1/NC=C(c2ccccc2)O1,Cc1ccccc1,315.0
O=C1C=CC(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=C/C1=C1/Nc2ccccc2O1,Cc1ccccc1,320.0
O=C1C=CC2=Cc3ccccc3B(O)N12,CC#N,360.0
O=C1C=CC2=Cc3ccccc3B(O)N12,CO,364.0
O=C1C=CC2=Cc3ccccc3B(O)N12,CS(C)=O,364.0
O=C1C=CC2=Cc3ccccc3B(O)N12,ClC(Cl)Cl,365.0
O=C1C=CC=C2C1=Cc1ccccc12,CCO,553.0
O=C1C=CN=CC1,CS(C)=O,313.0
O=C1C=Cc2cc3ccccc3c(=O)n21,CC#N,351.0
O=C1C=Cc2cc3ccccc3c(=O)n21,CO,349.0
O=C1C=Cc2cc3ccccc3c(=O)n21,CS(C)=O,357.0
O=C1C=Cc2cc3ccccc3c(=O)n21,ClC(Cl)Cl,353.0
O=C1CC(=O)C(P(c2ccccc2)c2ccccc2)=C1P(c1ccccc1)c1ccccc1,ClCCl,374.0
O=C1CC(=O)NC(=O)N1,ClCCl,514.0
O=C1CC(=O)NC(=S)N1,ClCCl,537.0
O=C1CC(=O)Nc2cc(Br)ccc2N1,CS(C)=O,299.0
O=C1CC(=O)Nc2cc(Cl)ccc2N1,CS(C)=O,298.0
O=C1CC(=O)Nc2ccccc2N1,CS(C)=O,285.0
O=C1CC(=O)OC(Nc2ccccc2)O1,C1COCCO1,569.0
O=C1CC(c2ccc(C(F)(F)F)cc2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,ClC(Cl)Cl,409.0
O=C1CC(c2ccc(F)cc2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,ClC(Cl)Cl,410.0
O=C1CC(c2ccc([N+](=O)[O-])cc2)c2c(c3ccccc3c3nc4cc(Cl)c(Cl)cc4nc23)O1,ClC(Cl)Cl,421.0
O=C1CC(c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,CCCCCC,407.0
O=C1CC(c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,CCOC(C)=O,409.0
O=C1CC(c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,CN(C)C=O,410.0
O=C1CC(c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,CO,407.0
O=C1CC(c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,CS(C)=O,412.0
O=C1CC(c2cccc([N+](=O)[O-])c2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,ClC(Cl)Cl,409.0
O=C1CC(c2ccccc2)c2c(c3ccccc3c3nc4ccccc4nc23)O1,ClC(Cl)Cl,410.0
O=C1CCC(=O)c2c1c1ccccc1c1nc3ccc4cnncc4c3nc21,CN(C)C=O,404.0
O=C1CCCC2=C1C(c1ccc([N+](=O)[O-])cc1)c1c(c3ccccc3oc1=O)N2,CS(C)=O,373.0
O=C1CCCC2=C1C(c1cccc(Cl)c1)c1c(c3ccccc3oc1=O)N2,CS(C)=O,373.0
O=C1CCCC2=C1C(c1ccccc1)c1c(c3ccccc3oc1=O)N2,CS(C)=O,368.0
O=C1CCCC2=C1CC1=C(CCCC1=O)N2NC(=O)c1ccc(O)cc1,CC#N,368.0
O=C1CCCC2=C1CC1=C(CCCC1=O)N2NC(=O)c1ccc(O)cc1,CC(C)=O,368.0
O=C1CCCC2=C1CC1=C(CCCC1=O)N2NC(=O)c1ccc(O)cc1,CCCCCO,376.0
O=C1CCCC2=C1CC1=C(CCCC1=O)N2NC(=O)c1ccc(O)cc1,CO,376.0
O=C1CCCC2=C1CC1=C(CCCC1=O)N2NC(=O)c1ccc(O)cc1,ClC(Cl)Cl,368.0
O=C1CCCC2=C1CC1=C(CCCC1=O)N2NC(=O)c1ccc(O)cc1,ClCCl,372.0
O=C1CCCCC1,CS(C)=O,554.0
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,C1CCOC1,337.2954616
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,CC#N,335.3284223
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,CCCCCCO,343.2296576
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,CCO,338.8647643
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,CCOC(C)=O,335.8438365
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,CS(C)=O,340.3426791
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,O,341.0864814
O=C1CCCc2c1[nH]c1cc3c(cc21)OCO3,c1ccccc1,339.2857143
O=C1CN2c3ccc(Br)cc3CC2N1,C1CCOC1,298.0
O=C1CN2c3ccccc3CC2N1,C1CCOC1,287.0
O=C1CN=CN1,CO,459.0
O=C1Cc2cc3c(cc2CCCc2ccc(cc2)CCC3)CC(=O)Cc2ccc(c3nsnc23)C1,C1CCCCC1,401.0
O=C1Cc2cc3c(cc2CCCc2ccc(cc2)CCC3)CC(=O)Cc2ccc(c3nsnc23)C1,CC#N,404.0
O=C1Cc2cc3c(cc2CCCc2ccc(cc2)CCC3)CC(=O)Cc2ccc(c3nsnc23)C1,ClC(Cl)Cl,404.0
O=C1Cc2ccc(cc2)CC(=O)Cc2ccc(c3nsnc23)C1,C1CCCCC1,384.0
O=C1Cc2ccc(cc2)CC(=O)Cc2ccc(c3nsnc23)C1,CC#N,382.0
O=C1Cc2ccc(cc2)CC(=O)Cc2ccc(c3nsnc23)C1,ClC(Cl)Cl,384.0
O=C1Cc2ccccc2C1=O,Clc1ccccc1,613.0
O=C1NC(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccc(/C=C4\NC(=O)NC4=O)cc3)cc2)N1,C1CCOC1,457.0
O=C1NC(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)N1,C1CCOC1,427.0
O=C1NC(=O)/C(=C/c2ccc(N(c3ccccc3)c3ccccc3)cc2)S1,C1CCOC1,433.0
O=C1NC(=O)/C(=C\c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4nsnc34)s2)N1,ClC(Cl)Cl,522.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,C1CCCCC1,347.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,C1COCCO1,350.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,CC#N,348.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,CN(C)C=O,353.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,CO,352.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,O,351.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,OCC(O)CO,364.0
O=C1NC(=O)/C(=C\c2ccccc2O)S1,OCCO,360.0
O=C1NC(=O)C(=Cc2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4nsnc34)s2)N1,ClC(Cl)Cl,522.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,C1CCOC1,450.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,CC#N,446.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,CC(C)OC(C)C,443.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,CCCCOCCCC,445.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,CCO,460.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,CCOC(C)=O,445.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,CN(C)C=O,454.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,Cc1ccccc1,447.0
O=C1NC(=O)C(c2c[nH]c3ccccc23)=C1c1c[nH]c2ccccc12,ClCCl,448.0
O=C1NC(=O)[C@H]([C@H]2C[C@H](O)[C@@H](CO)O2)C=C1C#Cc1ccc2c(c1)C(=O)c1ccccc1-2,CO,341.0
O=C1NC(=O)[C@H]([C@H]2C[C@H](O)[C@@H](CO)O2)C=C1C#Cc1ccc2c(c1)C(=O)c1ccccc1-2,ClC(Cl)Cl,345.0
O=C1NC(=O)[C@H]([C@H]2C[C@H](O)[C@@H](CO)O2)C=C1C#Cc1ccc2c(c1)C(=O)c1ccccc1-2,O,342.0
O=C1NC(=O)[C@H]([C@H]2C[C@H](O)[C@@H](CO)O2)C=C1C#Cc1ccc2c(c1)Cc1ccccc1-2,CO,370.0
O=C1NC(=O)[C@H]([C@H]2C[C@H](O)[C@@H](CO)O2)C=C1C#Cc1ccc2c(c1)Cc1ccccc1-2,ClC(Cl)Cl,375.0
O=C1NC(=O)[C@H]([C@H]2C[C@H](O)[C@@H](CO)O2)C=C1C#Cc1ccc2c(c1)Cc1ccccc1-2,O,358.0
O=C1NC(=O)c2c1c1c([nH]c2=O)C1,Cl,423.0
O=C1NC(=O)c2ccc(N3CCCCC3)c3cccc1c23,ClC(Cl)Cl,414.0
O=C1NC(=O)c2ccc(N3CCOCC3)c3cccc1c23,ClC(Cl)Cl,394.0
O=C1NC(=O)c2ccc3c4ccc5c6c(ccc(c7ccc1c2c73)c64)C(=O)N(c1ccc(Cl)cc1)C5=O,CN(C)C=O,526.0
O=C1NC(=O)c2ccc3c4ccc5c6c(ccc(c7ccc1c2c73)c64)C(=O)N(c1ccc(O)cc1)C5=O,CN(C)C=O,522.0
O=C1NC(c2ccc(C=Cc3ccccc3)cc2)=C2C(=O)NC(c3ccc(C=Cc4ccccc4)cc3)=C12,ClCCl,564.0
O=C1NC(c2ccccc2)=C2C(=O)NC(c3ccccc3)=C12,CS(C)=O,507.0
O=C1NC(c2ccccc2)=C2C(=O)OC(c3ccc(Br)cc3)=C12,CS(C)=O,493.0
O=C1NC(c2ccccc2)=C2C(=O)OC(c3ccc([N+](=O)[O-])cc3)=C12,CS(C)=O,511.0
O=C1NC(c2ccccc2)=C2C(=O)OC(c3cccnc3)=C12,CS(C)=O,487.0
O=C1NC(c2ccccc2)=N/C1=C\c1ccccc1,C1COCCO1,384.0
O=C1NC(c2ccccn2)Nc2ccccc21,ClC(Cl)Cl,340.0
O=C1NC(c2cccnc2)Nc2ccccc21,ClC(Cl)Cl,332.2
O=C1NC(c2ccncc2)Nc2ccccc21,ClC(Cl)Cl,340.0
O=C1NNC(O)c2ccc3nc(-c4ccccc4)c(-c4ccccc4)nc3c21,CN(C)C=O,367.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,C1CCCCC1,335.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,C1COCCO1,335.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CC#N,332.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CC(C)(C)O,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CC(C)O,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CCCCCC,334.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CCCCO,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CCOC(C)=O,335.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CN(C)C=O,337.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,CO,340.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,ClCCl,338.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1,O,341.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,C1CCCCC1,336.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,C1COCCO1,337.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CC#N,334.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CC(C)(C)O,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CC(C)O,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CCCCCC,334.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CCCCO,341.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CCOC(C)=O,335.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CN(C)C=O,340.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,CO,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,ClCCl,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(Cl)cc1Cl,O,340.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,C1CCCCC1,333.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,C1COCCO1,334.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CC#N,332.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CC(C)(C)O,336.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CC(C)O,338.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CCCCCC,331.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CCCCO,337.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CCOC(C)=O,334.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CN(C)C=O,337.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,CO,336.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,ClCCl,336.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccc(O)cc1,O,338.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,C1CCCCC1,335.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,C1COCCO1,335.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CC#N,334.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CC(C)(C)O,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CC(C)O,339.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CCCCCC,333.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CCCCO,340.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CCOC(C)=O,335.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CN(C)C=O,337.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,CO,340.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,ClCCl,337.0
O=C1Nc2ccccc2/C1=C/C(=O)c1ccccc1,O,336.0
O=C1Nc2ccccc2C1=Cc1ccc(-c2ccccc2)cc1,CS(C)=O,345.0
O=C1O/C(=C\c2ccccc2)c2ccccc21,CC#N,335.0
O=C1O/C(=C\c2cccs2)c2ccccc21,CC#N,355.0
O=C1OC(=O)C2=C1S[C@]13C2=C[C@H](c2ccccc21)c1ccccc13,ClCCl,421.0
O=C1OC(=O)C2=C1[Se][C@]13C2=C[C@H](c2ccccc21)c1ccccc13,ClCCl,421.0
O=C1OC(=O)[C@H]2[C@@H]1[C@@H]1C[C@H]2c2c1c(-c1ccccc1)c1ccccc1c2-c1ccccc1,ClC(Cl)Cl,295.0
O=C1OC(=O)c2cc(Oc3ccccc3)c3c4ccc5c6c(cc(Oc7ccccc7)c(c7ccc1c2c73)c64)C(=O)OC5=O,C1CCOC1,516.0
O=C1OC(=O)c2cc(Oc3ccccc3)c3c4ccc5c6c(cc(Oc7ccccc7)c(c7ccc1c2c73)c64)C(=O)OC5=O,CN(C)C=O,530.0
O=C1OC(=O)c2cc(Oc3ccccc3)c3c4ccc5c6c(cc(Oc7ccccc7)c(c7ccc1c2c73)c64)C(=O)OC5=O,CN1CCCC1=O,529.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3c4ccccc4cc4ccccc34)c3cccc1c23,C1CCOC1,450.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3c4ccccc4cc4ccccc34)c3cccc1c23,CCCCCC,440.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3c4ccccc4cc4ccccc34)c3cccc1c23,ClCCl,462.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3c4ccccc4cc4ccccc34)c3cccc1c23,c1ccccc1,450.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)c3cccc1c23,C1CCOC1,455.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)c3cccc1c23,CCCCCC,447.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)c3cccc1c23,ClCCl,465.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccc5cccc6ccc3c4c56)c3cccc1c23,c1ccccc1,457.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)c3cccc1c23,C1CCOC1,455.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)c3cccc1c23,CCCCCC,446.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)c3cccc1c23,ClCCl,470.0
O=C1OC(=O)c2ccc(N(c3ccccc3)c3ccc4ccccc4c3)c3cccc1c23,c1ccccc1,459.0
O=C1OC(=O)c2ccc3c4ccc(Br)c5cccc(c6ccc1c2c63)c54,CS(C)=O,503.0
O=C1OC(=O)c2ccc3c4cccc5cccc(c6ccc1c2c63)c54,CS(C)=O,495.0
O=C1OC(=O)c2ccc3c4cccc5cccc(c6ccc1c2c63)c54,ClC(Cl)Cl,544.0
O=C1OC(=O)c2cccc3cccc1c23,O=S(=O)(O)CCCN1CCOCC1,342.0
O=C1OC(c2ccccc2)=C/C1=C\c1ccc([N+](=O)[O-])cc1,C1COCCO1,416.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,472.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,469.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,C1COCCO1,466.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC#N,464.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC(C)=O,465.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC(C)CC(C)(C)C,468.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CC1CCCCC1,471.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCCCC,466.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCCCCC,468.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCCCCCC,469.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCCCOCCCC,469.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCOC(C)=O,466.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CCOCC,466.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,471.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,CS(C)=O,474.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,475.5
O=C1OC(c2ccccc2)=N/C1=C\c1ccc(N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,479.0
O=C1OC(c2ccccc2)=N/C1=C\c1ccccc1,C1COCCO1,363.0
O=C1OC(c2ccccc2)=NC1=Cc1ccc(C=Cc2nc3ccccc3[nH]2)cc1,C1CCOC1,424.0
O=C1OC(c2ccccc2)=NC1=Cc1ccc([N+](=O)[O-])cc1,C1CCOC1,379.0
O=C1OC(c2ccccc2)=NC1=Cc1ccccc1,C1CCOC1,363.0
O=C1OC(c2ccccc2)=NC1=Cc1ccco1,C1CCOC1,389.0
O=C1OC2(c3ccccc31)c1ccc(O)c(Br)c1Oc1c2ccc(O)c1Br,O,506.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,C1CCCCC1,315.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,C1CCOC1,320.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,C1COCCO1,319.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CC#N,322.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CC(C)O,323.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CCCCCC,316.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CCCCCCC,316.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CCCCCCCCO,323.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CCCCO,323.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CCO,323.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,CO,323.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,ClC(Cl)Cl,321.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,ClCCl,321.0
O=C1OCC2=C1C(c1ccccc1)c1cc3c(cc1N2CCO)CCC3,O,327.0
O=C1O[B-]2(OC1=O)OC(c1ccc3ccccc3c1)=CC(c1ccc3ccccc3c1)=[O+]2,CC#N,435.0
O=C1O[B-]2(OC1=O)OC(c1ccc3ccccc3c1)=CC(c1ccc3ccccc3c1)=[O+]2,ClC(Cl)(Cl)Cl,438.0
O=C1O[B-]2(OC1=O)OC(c1ccccc1)=CC(c1ccc3ccccc3c1)=[O+]2,CC#N,435.0
O=C1O[B-]2(OC1=O)OC(c1ccccc1)=CC(c1ccc3ccccc3c1)=[O+]2,ClC(Cl)(Cl)Cl,435.0
O=C1[C@H]2[C@@H]3C[C@@H](c4c3c(-c3ccccc3)c3ccccc3c4-c3ccccc3)[C@H]2C(=O)N1c1ccc2cc3ccccc3cc2c1,ClC(Cl)Cl,380.0
O=C1[C@H]2[C@@H]3C[C@@H](c4c3c(-c3ccccc3)c3ccccc3c4-c3ccccc3)[C@H]2C(=O)N1c1cccc2cc3ccccc3cc12,ClC(Cl)Cl,385.0
O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1ccc2cc3ccccc3cc2c1,ClC(Cl)Cl,380.0
O=C1c2cc(-n3c4ccccc4c4ccccc43)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,C1CCOC1,406.0
O=C1c2cc(-n3c4ccccc4c4ccccc43)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,CCCCCC,406.0
O=C1c2cc(-n3c4ccccc4c4ccccc43)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,Cc1ccccc1,406.0
O=C1c2cc(-n3c4ccccc4c4ccccc43)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClC(Cl)Cl,406.0
O=C1c2cc(-n3c4ccccc4c4ccccc43)ccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClCCl,406.0
O=C1c2cc3ccccc3cc2C2=Nc3ccc4ccccc4[n+]3[B-](F)(F)N12,ClCCl,419.0
O=C1c2cc3ccccc3cc2C2=Nc3cccc[n+]3[B-](F)(F)N12,ClCCl,396.0
O=C1c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2C(=O)c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc21,Cc1ccccc1,456.0
O=C1c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2C(=O)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc21,Cc1ccccc1,454.0
O=C1c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc2C(=O)c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccccc4)cc3)cc21,Cc1ccccc1,464.0
O=C1c2ccc(N(c3ccccc3)c3ccccc3)cc2C(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc21,Cc1ccccc1,449.0
O=C1c2ccc3c4c(-c5ccccc5)cc5c6c(ccc(c7c(-c8ccccc8)cc(c2c37)C(=O)N1C1CCCCC1)c64)C(=O)N(C1CCCCC1)C5=O,ClC(Cl)Cl,556.0
O=C1c2ccc3c4c(NC5CCCCC5)cc5c6c(ccc(c7c(NC8CCCCC8)cc(c2c37)C(=O)N1C1CCCCC1)c64)C(=O)N(C1CCCCC1)C5=O,ClC(Cl)Cl,703.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccc(O)cc1)c64)C(=O)N(c1ccc(O)cc1)C5=O,C1CCOC1,519.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccc(O)cc1)c64)C(=O)N(c1ccc(O)cc1)C5=O,CN(C)C=O,523.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccc(O)cc1)c64)C(=O)N(c1ccc(O)cc1)C5=O,CN1CCCC1=O,525.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,C1CCOC1,522.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,C1COCCO1,525.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CC(C)=O,519.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CC(C)O,525.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CCCCO,525.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CCO,524.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CCOC(C)=O,519.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CN(C)C=O,524.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CO,525.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,CS(C)=O,528.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,ClC(Cl)(Cl)Cl,524.0
O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1ccncc1)c64)C(=O)N(c1ccncc1)C5=O,ClC(Cl)Cl,530.0
O=C1c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C(=O)N1c1ccccc1,C1CCOC1,408.0
O=C1c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C(=O)N1c1ccccc1,CCCCCC,403.0
O=C1c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C(=O)N1c1ccccc1,ClC(Cl)Cl,405.0
O=C1c2cccc3c(-n4c5ccccc5c5ccccc54)ccc(c23)C(=O)N1c1ccccc1,ClCCl,419.0
O=C1c2cccc3c(C#CC#Cc4ccc5c6c(cccc46)C(=O)N(c4ccccc4)C5=O)ccc(c23)C(=O)N1c1ccccc1,ClCCl,386.0
O=C1c2cccc3c(NCc4ccccn4)c4ccccc4c(c23)C(=O)N1Cc1ccccn1,C1CCOC1,520.0
O=C1c2cccc3c(NCc4ccccn4)c4ccccc4c(c23)C(=O)N1Cc1ccccn1,CCCCCC,497.0
O=C1c2cccc3c(NCc4ccccn4)c4ccccc4c(c23)C(=O)N1Cc1ccccn1,CCO,533.0
O=C1c2cccc3c(NCc4ccccn4)c4ccccc4c(c23)C(=O)N1Cc1ccccn1,Cc1ccccc1,517.0
O=C1c2cccc3c(NCc4ccccn4)c4ccccc4c(c23)C(=O)N1Cc1ccccn1,ClCCl,527.0
O=C1c2cccc3cc(C#CC#Cc4cc5c6c(cccc6c4)C(=O)N(c4ccccc4)C5=O)cc(c23)C(=O)N1c1ccccc1,ClCCl,326.0
O=C1c2cccc3cc4ccccc4c(c23)C(=O)N1Cc1ccccn1,C1CCOC1,432.0
O=C1c2cccc3cc4ccccc4c(c23)C(=O)N1Cc1ccccn1,CCCCCC,427.0
O=C1c2cccc3cc4ccccc4c(c23)C(=O)N1Cc1ccccn1,CCO,436.0
O=C1c2cccc3cc4ccccc4c(c23)C(=O)N1Cc1ccccn1,Cc1ccccc1,435.0
O=C1c2cccc3cc4ccccc4c(c23)C(=O)N1Cc1ccccn1,ClCCl,437.0
O=C1c2ccccc2-c2c(-c3cc(Br)ccc3O)[nH]c(=O)n21,CC#N,390.0
O=C1c2ccccc2-c2c(-c3cc(Br)ccc3O)[nH]c(=O)n21,CO,400.0
O=C1c2ccccc2-c2c(-c3cc(Br)ccc3O)[nH]c(=O)n21,ClCCl,396.0
O=C1c2ccccc2-c2c(-c3cc(Cl)ccc3O)[nH]c(=O)n21,CC#N,390.0
O=C1c2ccccc2-c2c(-c3cc(Cl)ccc3O)[nH]c(=O)n21,CO,393.0
O=C1c2ccccc2-c2c(-c3cc(Cl)ccc3O)[nH]c(=O)n21,ClCCl,395.0
O=C1c2ccccc2-c2c(-c3ccc([N+](=O)[O-])cc3)c(-c3ccc([N+](=O)[O-])cc3)c(-c3ccccc3)c3cccc1c23,CC#N,396.0
O=C1c2ccccc2-c2c(-c3ccc([N+](=O)[O-])cc3)c(-c3ccc([N+](=O)[O-])cc3)c(-c3ccccc3)c3cccc1c23,CO,400.0
O=C1c2ccccc2-c2c(-c3cccc(Cl)c3O)[nH]c(=O)n21,CC#N,388.0
O=C1c2ccccc2-c2c(-c3cccc(Cl)c3O)[nH]c(=O)n21,CO,393.0
O=C1c2ccccc2-c2c(-c3cccc(Cl)c3O)[nH]c(=O)n21,ClCCl,391.0
O=C1c2ccccc2-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c3cccc1c23,CC#N,401.0
O=C1c2ccccc2-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c3cccc1c23,CO,407.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,C1CCCCC1,423.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,C1CCOC1,438.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,C1COCCO1,436.2
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CC#N,444.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CC(C)=O,441.2
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CC1COC(=O)O1,445.6
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CCCCCCCCO,445.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CCCCCO,446.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CCCCO,444.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CCCO,445.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CCO,446.8
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CCOC(C)=O,436.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CN(C)C=O,447.2
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CO,445.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,CS(C)=O,452.0
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,Cc1ccccc1,435.8
O=C1c2ccccc2-c2ccc(N3CCN(c4ccccc4)CC3)c3cccc1c23,ClC(Cl)Cl,443.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,C1CCOC1,437.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,CCCCCC,419.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,CCO,444.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,CCOC(C)=O,434.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,CN(C)C=O,443.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,CO,442.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,Cc1ccccc1,434.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,ClC(Cl)(Cl)Cl,427.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,ClC(Cl)Cl,433.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,ClCCl,433.0
O=C1c2ccccc2-c2ccc(N3CCOCC3)c3cccc1c23,c1ccccc1,434.0
O=C1c2ccccc2-c2ccc(NCCCl)c3cccc1c23,c1ccccc1,482.0
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,CC(C)=O,405.0222762
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,CC(C)O,411.8616145
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,CCCCOCCCC,400.9623095
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,CCOC(C)=O,403.0632809
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,CO,410.0041
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,Cc1ccccc1,411.0152076
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,Clc1ccccc1,410.0041
O=C1c2ccccc2-c2ccc(Nc3nc(Cl)nc(Cl)n3)c3cccc1c23,O=C1CCCCC1,410.0041
O=C1c2ccccc2-c2ccccc21,C1CCCCC1,382.0
O=C1c2ccccc2-c2ccccc21,CC#N,377.0
O=C1c2ccccc2-c2ccccc21,CCO,379.0
O=C1c2ccccc2-c2ccccc21,c1ccccc1,380.0
O=C1c2ccccc2-c2nc3c(F)c(F)c(F)c(F)c3n21,ClCCl,337.0
O=C1c2ccccc2-c2nc3c4ccccc4c4ccccc4c3n21,ClCCl,441.0
O=C1c2ccccc2-c2nc3ccccc3n21,ClCCl,340.0
O=C1c2ccccc2C(=O)C1C1C(=O)c2c3ccccc3cc3cc4ccccc4c1c23,ClCCl,505.7209574
O=C1c2ccccc2C(=O)C1c1ccc2cccc(N3C(=O)c4ccccc4C3=O)c2n1,COCC(C)OC(C)=O,452.0
O=C1c2ccccc2C(=O)c2c(-c3ccccc3)ccc(-c3ccccc3)c21,ClC(Cl)Cl,265.0
O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccc(Br)cc3)c(-c3ccc(Br)cc3)nc21,CCCCCC,266.0
O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccc(F)cc3)c(-c3ccc(F)cc3)nc21,CCCCCC,264.0
O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccccc3)c(-c3ccccc3)nc21,CCCCCC,262.0
O=C1c2ccccc2C(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,C1CCOC1,447.0
O=C1c2ccccc2C(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,CCCCCC,442.0
O=C1c2ccccc2C(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,CCOC(C)=O,446.0
O=C1c2ccccc2C(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,CCOCC,443.0
O=C1c2ccccc2C(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,Cc1ccccc1,454.0
O=C1c2ccccc2C(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,ClC(Cl)(Cl)Cl,457.0
O=C1c2ccccc2C(=O)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,459.0
O=C1c2ccccc2C2=Cc3cc4c(cc3B(O)N12)OCO4,CC#N,392.0
O=C1c2ccccc2C2=Cc3cc4c(cc3B(O)N12)OCO4,CO,394.0
O=C1c2ccccc2C2=Cc3cc4c(cc3B(O)N12)OCO4,CS(C)=O,396.0
O=C1c2ccccc2C2=Cc3cc4c(cc3B(O)N12)OCO4,ClC(Cl)Cl,397.0
O=C1c2ccccc2C2=Cc3ccc4ccccc4[n+]3[B-](F)(F)N12,CCO,450.0
O=C1c2ccccc2C2=Cc3ccc4ccccc4[n+]3[B-](F)(F)N12,Cc1ccccc1,458.0
O=C1c2ccccc2C2=Cc3ccc4ccccc4[n+]3[B-](F)(F)N12,ClCCl,454.0
O=C1c2ccccc2C2=Cc3cccc[n+]3[B-](F)(F)N12,CCO,391.0
O=C1c2ccccc2C2=Cc3cccc[n+]3[B-](F)(F)N12,Cc1ccccc1,399.0
O=C1c2ccccc2C2=Cc3ccccc3B(O)N12,CC#N,371.0
O=C1c2ccccc2C2=Cc3ccccc3B(O)N12,CO,372.0
O=C1c2ccccc2C2=Cc3ccccc3B(O)N12,CS(C)=O,372.0
O=C1c2ccccc2C2=Cc3ccccc3B(O)N12,ClC(Cl)Cl,375.0
O=C1c2ccccc2C2=Nc3ccc4ccccc4[n+]3[B-](F)(F)N12,ClCCl,387.0
O=C1c2ccccc2C2=Nc3cccc4cccc(c34)N12,ClCCl,448.0
O=C1c2ccccc2C2=Nc3cccc[n+]3[B-](F)(F)N12,ClCCl,361.0
O=C1c2ccccc2NC(c2ccccc2)N1Cc1ccccc1,CC#N,337.0
O=C1c2ccccc2NC(c2ccccc2)N1Cc1ccccc1,CCCCCCCCCCCCCCCC,325.0
O=C1c2ccccc2NC(c2ccccc2)N1Cc1ccccc1,CO,345.0
O=C1c2ccccc2NC(c2ccccc2)N1Cc1ccccc1,ClC(Cl)Cl,336.0
O=C1c2ccccc2NC(c2ccccc2)N1Cc1ccccc1,c1ccccc1,334.0
O=C1c2ccccc2NCN1Cc1ccccc1,CC#N,332.0
O=C1c2ccccc2NCN1Cc1ccccc1,CCCCCCCCCCCCCCCC,323.0
O=C1c2ccccc2NCN1Cc1ccccc1,CO,340.0
O=C1c2ccccc2NCN1Cc1ccccc1,ClC(Cl)Cl,329.0
O=C1c2ccccc2NCN1Cc1ccccc1,c1ccccc1,329.0
O=C1c2ccccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,C1CCOC1,404.0
O=C1c2ccccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,CCCCCC,404.0
O=C1c2ccccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,Cc1ccccc1,404.0
O=C1c2ccccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClC(Cl)Cl,404.0
O=C1c2ccccc2S(=O)(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClCCl,404.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,C1CCCCC1,395.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,C1CCOC1,375.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,C1COCCO1,379.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,CC#N,368.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,CCOCC,379.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,CN(C)C=O,372.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,CO,377.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,Cc1ccccc1,386.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,ClC(Cl)Cl,389.0
O=C1c2cccn2[B-](F)(F)[n+]2ccccc21,ClCCl,382.0
O=CC1=C(c2ccc(-c3cccs3)s2)CC1,C1CCOC1,388.0
O=CC1=C(c2ccc(-c3cccs3)s2)CC1,CC#N,387.0
O=CC1=C(c2ccc(-c3cccs3)s2)CC1,CCCCCC,380.0
O=CC1=C(c2ccc(-c3cccs3)s2)CC1,CCO,396.0
O=CC1=C(c2ccc(-c3cccs3)s2)CC1,OCCOCCO,384.0
O=CC1=C(c2ccc(-c3cccs3)s2)CC1,c1ccncc1,395.0
O=CC1=C(c2ccc(-c3cccs3)s2)CCC1,C1CCOC1,377.0
O=CC1=C(c2ccc(-c3cccs3)s2)CCC1,CC#N,374.0
O=CC1=C(c2ccc(-c3cccs3)s2)CCC1,CCCCCC,366.0
O=CC1=C(c2ccc(-c3cccs3)s2)CCC1,CCO,386.0
O=CC1=C(c2ccc(-c3cccs3)s2)CCC1,OCCOCCO,377.0
O=CC1=C(c2ccc(-c3cccs3)s2)CCC1,c1ccncc1,385.0
O=CC1=Cc2c(-c3ccc(-c4ccccc4)cc3)oc(-c3ccc(-c4ccccc4)cc3)c2C=C(C=O)C1,ClC(Cl)Cl,382.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,C1COCCO1,356.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,CCO,360.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,CN(C)C=O,364.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,CS(C)=O,364.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,Cc1ccccc1,359.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,ClC(Cl)Cl,364.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,ClCCCl,366.0
O=CC1=Cc2c(-c3ccccc3)oc(-c3ccccc3)c2C=C(C=O)C1,ClCCl,364.0
O=CC1=Cc2cocc2C=C(C=O)C1,ClC(Cl)Cl,303.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,C1CCCCC1,305.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,C1COCCO1,303.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,CC#N,298.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,CCO,297.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,CCOC(C)=O,301.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,CO,298.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,CS(C)=O,302.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,Cc1ccccc1,306.0
O=CN1N=C(c2ccc(Br)cc2)C[C@@H]1c1ccccc1,ClC(Cl)(Cl)Cl,306.0
O=CNC1=CC(=O)C(=O)c2ccccc21,CCO,271.0
O=COCc1ccccc1[N+](=O)[O-],CC#N,260.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,C1CCOC1,352.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,CC#N,349.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,CC(C)=O,352.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,CCO,349.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,CCOC(C)=O,352.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,CN(C)C=O,346.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,CO,349.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,Cc1ccccc1,358.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,ClC(Cl)Cl,352.0
O=Cc1c(O)c(-c2nc3ccccc3s2)cc2ccccc12,ClCCl,352.0
O=Cc1c(O)c2ccccc2n(-c2ccccc2)c1=O,CO,399.5
O=Cc1c2c(cc3ccc(N4CCCC4)cc13)CCC2,ClCCl,440.0
O=Cc1c2cc(OCc3ccccc3)ccc2n2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c12,CC#N,402.0
O=Cc1c2cc(OCc3ccccc3)ccc2n2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c12,CS(C)=O,408.0
O=Cc1cc(Br)ccc1O,CCO,313.0
O=Cc1cc(C=O)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,C1COCCO1,483.0
O=Cc1cc(C=O)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CC(C)=O,486.0
O=Cc1cc(C=O)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CCCCCC,478.0
O=Cc1cc(C=O)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CCOC(C)=O,484.0
O=Cc1cc(C=O)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,Cc1ccccc1,491.0
O=Cc1cc(C=O)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,ClCCl,498.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,C1COCCO1,488.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,CC#N,490.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,CC(C)=O,488.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,CCCCCC,478.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,CCO,486.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,CCOC(C)=O,486.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,CO,482.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,CS(C)=O,497.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,Cc1ccccc1,492.0
O=Cc1cc(N2CCCCC2)c2ccc3c(C=O)cc(N4CCCCC4)c4ccc1c2c34,ClCCl,498.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,C1COCCO1,475.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CC#N,482.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CC(C)=O,479.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CCCCCC,466.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CCO,477.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CCOC(C)=O,474.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CO,473.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,CS(C)=O,490.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,Cc1ccccc1,481.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(C=O)c4ccc1c2c43,ClCCl,489.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,C1COCCO1,476.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,CC#N,482.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,CC(C)=O,477.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,CCCCCC,466.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,CCO,480.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,CCOC(C)=O,475.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,CO,480.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,CS(C)=O,490.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,Cc1ccccc1,478.0
O=Cc1cc(N2CCCCC2)c2ccc3c(N4CCCCC4)cc(N4CCCCC4)c4ccc1c2c43,ClCCl,489.0
O=Cc1cc(N=Nc2ccc(Br)cc2)ccc1O,ClCCl,240.0
O=Cc1cc(O)c(C=O)cc1O,C1CCOC1,414.0
O=Cc1cc(O)c(C=O)cc1O,C1COCCO1,414.0
O=Cc1cc(O)c(C=O)cc1O,CC#N,413.0
O=Cc1cc(O)c(C=O)cc1O,CC(C)=O,413.0
O=Cc1cc(O)c(C=O)cc1O,CCCO,415.0
O=Cc1cc(O)c(C=O)cc1O,CCO,413.0
O=Cc1cc(O)c(C=O)cc1O,CN(C)C=O,414.0
O=Cc1cc(O)c(C=O)cc1O,CN(C)P(=O)(N(C)C)N(C)C,427.0
O=Cc1cc(O)c(C=O)cc1O,CNC=O,377.0
O=Cc1cc(O)c(C=O)cc1O,CO,384.0
O=Cc1cc(O)c(C=O)cc1O,CS(C)=O,417.0
O=Cc1cc(O)c(C=O)cc1O,NC=O,356.0
O=Cc1cc(O)ccc1O,C1CCOC1,366.0
O=Cc1cc(O)ccc1O,C1COCCO1,363.0
O=Cc1cc(O)ccc1O,CC#N,362.0
O=Cc1cc(O)ccc1O,CC(C)=O,364.0
O=Cc1cc(O)ccc1O,CCCO,367.0
O=Cc1cc(O)ccc1O,CCO,367.0
O=Cc1cc(O)ccc1O,CN(C)C=O,365.0
O=Cc1cc(O)ccc1O,CN(C)P(=O)(N(C)C)N(C)C,369.0
O=Cc1cc(O)ccc1O,CNC=O,358.0
O=Cc1cc(O)ccc1O,CO,364.0
O=Cc1cc(O)ccc1O,CS(C)=O,366.0
O=Cc1cc(O)ccc1O,ClC(Cl)Cl,362.0
O=Cc1cc(O)ccc1O,NC=O,363.0
O=Cc1cc2c(cc3ccc4cccc5ccc2c3c45)[nH]1,CCOC(C)=O,416.0
O=Cc1cc2c3c([n+]4c(-c5ccccc5)c(-c5ccccc5)c5ccccc5c4c(-c4ccccc4)c3c1)OC(c1ccccc1)=C2c1ccccc1,ClCCl,548.0
O=Cc1cc2c3c([o+]c(-c4ccccc4)c(-c4ccccc4)c3c1)N1C(c3ccccc3)=C(c3ccccc3)c3ccccc3C1=C2c1ccccc1,ClCCl,548.0
O=Cc1ccc(-c2c3ccccc3nn2-c2ccccn2)o1,CC#N,362.0
O=Cc1ccc(-c2c3ccccc3nn2-c2ccccn2)o1,ClCCl,368.0
O=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)o1,ClCCl,373.0
O=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)o1,O,326.0
O=Cc1ccc(-c2ccc(-c3nc4ccccc4s3)c(O)c2)s1,CCO,376.0
O=Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,C1CCOC1,385.0
O=Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,CC#N,385.0
O=Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,CCCCCC,380.0
O=Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,CCO,391.0
O=Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,OCCOCCO,389.0
O=Cc1ccc(-c2ccc(C3=CCC(c4ccccc4)CC3)s2)s1,c1ccncc1,393.0
O=Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,C1CCOC1,385.0
O=Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,CC#N,358.0
O=Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,CCCCCC,381.0
O=Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,CCO,389.0
O=Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,OCCOCCO,389.0
O=Cc1ccc(-c2ccc(C3=CCCCC3)s2)s1,c1ccncc1,392.0
O=Cc1ccc(-c2ccc(O)c(-c3nc4ccccc4s3)c2)o1,CCO,341.0
O=Cc1ccc(-c2ccc(O)c(-c3nc4ccccc4s3)c2)s1,ClCCl,350.0
O=Cc1ccc(-c2ccc(O)c(-c3nc4ccccc4s3)c2)s1,O,338.0
O=Cc1ccc(-c2ccc3c4ccc(N(c5ccccc5)c5ccccc5)cc4n(CCCCCCC(=O)O)c3c2)cc1,C1COCCO1,384.0
O=Cc1ccc(-c2cccc(-c3nc4ccccc4s3)c2O)s1,CCO,367.0
O=Cc1ccc(-c2cccc(-c3nc4ccccc4s3)c2O)s1,ClCCl,370.0
O=Cc1ccc(-c2cccs2)s1,CC#N,350.0
O=Cc1ccc(-c2ccnc3ncnn23)cc1,ClCCl,309.0
O=Cc1ccc(-c2nc3ncccn3n2)cc1,ClCCl,305.0
O=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,C1CCOC1,409.0
O=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CC#N,408.0
O=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CCCCCC,401.0
O=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CS(C)=O,416.0
O=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,Cc1ccccc1,412.0
O=Cc1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,ClCCl,415.0
O=Cc1ccc(-c2scc3c2OCCO3)cc1,ClCCl,445.0
O=Cc1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,392.0
O=Cc1ccc(/C=C/c2nc(N3CCOCC3)c3c([n+]2[O-])CCCC3)cc1,ClCCl,418.0
O=Cc1ccc(C#CC(C#Cc2ccc(C=O)o2)=Cc2ccc(C=C(C#Cc3ccc(C=O)o3)C#Cc3ccc(C=O)o3)cc2)o1,ClC(Cl)Cl,450.0
O=Cc1ccc(C#CC(C#Cc2ccc(C=O)o2)=Cc2ccc(C=C(C#Cc3ccc(C=O)o3)C#Cc3ccc(C=O)o3)s2)o1,ClC(Cl)Cl,516.0
O=Cc1ccc(C#CC(C#Cc2ccc(C=O)s2)=Cc2ccc(C=C(C#Cc3ccc(C=O)s3)C#Cc3ccc(C=O)s3)s2)s1,ClC(Cl)Cl,524.0
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,C1CCCCC1,592.5
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,C1CCOC1,589.0
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CC#N,585.5
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CCOC(C)=O,587.0
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CN(C)C=O,589.0
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,CO,583.0
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,Cc1ccccc1,597.0
O=Cc1ccc(C2=C3C=c4c(oc5ccccc45)=[N+]3[B-](F)(F)n3c2cc2c4ccccc4oc23)cc1,ClCCl,593.5
O=Cc1ccc(C2=Cc3ccccc3P2(=O)c2ccccc2)cc1,ClCCl,357.0
O=Cc1ccc(C=C(c2ccccc2)c2ccccc2)cc1,C1CCOC1,333.0
O=Cc1ccc(N(c2ccc(C=O)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,C1CCOC1,374.0
O=Cc1ccc(N(c2ccc(C=O)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,CCCCCC,368.0
O=Cc1ccc(N(c2ccc(C=O)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,CCOC(C)=O,371.0
O=Cc1ccc(N(c2ccc(C=O)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,CCOCC,369.0
O=Cc1ccc(N(c2ccc(C=O)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,Cc1ccccc1,376.0
O=Cc1ccc(N(c2ccc(C=O)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,ClC(Cl)(Cl)Cl,376.0
O=Cc1ccc(N(c2ccc(C=O)cc2)c2ccc(-c3ccc4c(c3)C(=O)c3ccccc3C4=O)cc2)cc1,ClCCl,379.0
O=Cc1ccc(Oc2ccc3c4c(cccc24)C(=O)N(CCO)C3=O)cc1,ClC(Cl)Cl,355.0
O=Cc1ccc([N+](=O)[O-])cc1,CCO,332.0
O=Cc1ccc2c(c1)Sc1ccccc1N2,ClCCl,395.0
O=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,CC#N,314.0
O=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,CCCCC,313.0
O=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,Cc1ccccc1,316.0
O=Cc1ccc2c(c1)c1ccccc1n2-c1cc2ccccc2c2ccccc12,ClCCl,321.0
O=Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4cc(C=O)ccc43)cc2)cc1,ClCCl,329.0
O=Cc1ccc2nc(C#Cc3ccc(N(c4ccc(C#Cc5nc6ccc(C=O)cc6s5)cc4)c4ccc(C#Cc5nc6ccc(C=O)cc6s5)cc4)cc3)sc2c1,Cc1ccccc1,421.0
O=Cc1ccc2nc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)sc2c1,Cc1ccccc1,411.0
O=Cc1ccccc1O,CCO,251.0
O=Cc1cnc(-c2c3ccccc3cc3ccccc23)nc1,CCO,381.0
O=Cc1cnc(-c2c3ccccc3cc3ccccc23)nc1,ClCCl,384.0
O=Cc1nc2ccc(C#Cc3ccc(N(c4ccc(C#Cc5ccc6nc(C=O)sc6c5)cc4)c4ccc(C#Cc5ccc6nc(C=O)sc6c5)cc4)cc3)cc2s1,Cc1ccccc1,414.0
O=Cc1nc2ccc(C#Cc3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2s1,Cc1ccccc1,412.0
O=P(c1c2ccccc2cc2ccccc12)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,C1CCOC1,411.0
O=P(c1ccc(N2c3ccccc3Oc3ccccc32)cc1)(c1ccc(N2c3ccccc3Oc3ccccc32)cc1)c1ccc(N2c3ccccc3Oc3ccccc32)cc1,Cc1ccccc1,371.0
O=P(c1ccccc1)(c1ccc(N2c3ccccc3Oc3ccccc32)cc1)c1ccc(N2c3ccccc3Oc3ccccc32)cc1,Cc1ccccc1,370.0
O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2nc3ccccc3n2-c2ccc(P(=O)(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,314.0
O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2nc3ccccc3n2-c2cccc(P(=O)(c3ccccc3)c3ccccc3)c2)cc1,ClCCl,314.0
O=P(c1ccccc1)(c1ccccc1)c1ccc(-n2c(-c3cccc(P(=O)(c4ccccc4)c4ccccc4)c3)nc3ccccc32)cc1,ClCCl,304.0
O=P(c1ccccc1)(c1ccccc1)c1ccc(-n2c(-c3ccccc3P(=O)(c3ccccc3)c3ccccc3)nc3ccccc32)cc1,ClCCl,300.0
O=P(c1ccccc1)(c1ccccc1)c1cccc(-c2nc3ccccc3n2-c2cccc(P(=O)(c3ccccc3)c3ccccc3)c2)c1,ClCCl,304.0
O=P(c1ccccc1)(c1ccccc1)n1c2ccccc2c2cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)ccc43)ccc21,C1CCOC1,341.0
O=P(c1ccccc1)(c1ccccc1)n1c2ccccc2c2cc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)ccc21,C1CCOC1,341.0
O=P(c1ccccc1)(c1ccccc1)n1c2ccccc2c2cc(-n3c4ccccc4c4ccccc43)ccc21,C1CCOC1,340.0
O=P(c1ccccc1)(c1ccccc1)n1c2ccccc2c2ccccc21,C1CCOC1,319.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,C1CCCCC1,451.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,C1CCOC1,451.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,C1COCCO1,448.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,CC#N,445.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,CC(C)=O,446.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,CO,444.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,Cc1ccccc1,453.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,ClC(Cl)Cl,452.0
O=P1(c2ccccc2)C(c2cc(C(F)(F)F)cc(C(F)(F)F)c2)=Cc2c3ccc4cccc5ccc(c6cc(-c7ccccc7)n1c26)c3c45,ClCCl,450.0
O=P1(c2ccccc2)C(c2ccc(C(F)(F)F)cc2)=Cc2cc3ccccc3cc21,ClCCl,387.0
O=P1(c2ccccc2)C(c2ccc(C(F)(F)F)cc2)=Cc2ccccc21,C1CCOC1,342.0
O=P1(c2ccccc2)C(c2ccc(C3=Cc4ccccc4P3(=O)c3ccccc3)cc2)=Cc2ccccc21,C1CCOC1,387.0
O=P1(c2ccccc2)C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=Cc2ccccc21,C1CCOC1,408.0
O=P1(c2ccccc2)C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=Cc2ccccc21,CC#N,407.0
O=P1(c2ccccc2)C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=Cc2ccccc21,CN(C)C=O,410.0
O=P1(c2ccccc2)C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=Cc2ccccc21,Cc1ccccc1,413.0
O=P1(c2ccccc2)C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=Cc2ccccc21,ClC(Cl)Cl,418.0
O=P1(c2ccccc2)C(c2ccc(N(c3ccccc3)c3ccccc3)cc2)=Cc2ccccc21,ClCCl,415.0
O=P1(c2ccccc2)C(c2ccccc2)=Cc2cc3ccccc3cc21,ClCCl,387.0
O=P1(c2ccccc2)C(c2cccs2)=C(c2cccs2)c2ccccc21,C1CCOC1,368.0
O=P1(c2ccccc2)C(c2cccs2)=Cc2ccccc21,C1CCOC1,368.0
O=P1(c2ccccc2)C(c2ccsc2)=C(c2ccsc2)c2ccccc21,C1CCOC1,355.0
O=P1(c2ccccc2)C2=C(c3ccccc31)C(c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccccc3)ccc12,CC#N,427.0
O=P1(c2ccccc2)C2=C(c3ccccc31)C(c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccccc3)ccc12,CO,438.0
O=P1(c2ccccc2)C2=C(c3ccccc31)C(c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccccc3)ccc12,Cc1ccccc1,431.0
O=P1(c2ccccc2)C2=C(c3ccccc31)[Si](c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccccc3)ccc12,CC#N,456.0
O=P1(c2ccccc2)C2=C(c3ccccc31)[Si](c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccccc3)ccc12,CO,466.0
O=P1(c2ccccc2)C2=C(c3ccccc31)[Si](c1ccccc1)(c1ccccc1)c1cc(N(c3ccccc3)c3ccccc3)ccc12,Cc1ccccc1,459.0
O=P1(c2ccccc2)C2=CC(=[N+]3CCC3)C=CC2=C(c2ccccc2C(F)(F)F)c2ccc(N3CCC3)cc21,O,710.0
O=P1(c2ccccc2)C2=CC(=[N+]3CCCC3)C=CC2=C(c2ccccc2C(F)(F)F)c2ccc(N3CCCC3)cc21,O,718.0
O=P1(c2ccccc2)c2cc(N3c4ccccc4Oc4ccccc43)ccc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc21,Cc1ccccc1,418.0
O=P1(c2ccccc2)c2ccc(N3c4ccccc4Oc4ccccc43)cc2-c2cc(N3c4ccccc4Oc4ccccc43)ccc21,Cc1ccccc1,405.0
O=P1(c2ccccc2)c2ccc(N3c4ccccc4Oc4ccccc43)cc2-c2cc(N3c4ccccc4Oc4ccccc43)ccc21,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,404.2
O=P1(c2ccccc2)c2ccc(N3c4ccccc4Sc4ccccc43)cc2-c2cc(N3c4ccccc4Sc4ccccc43)ccc21,Cc1ccccc1,422.0
O=P1(c2ccccc2)c2cccc3c4c5ccccc5c5ccccc5c4c4ccc1n4c23,ClCCl,425.0
O=P1(c2ccccc2)c2cccc3c4ccccc4c4ccc1n4c23,ClCCl,378.0
O=P1(c2ccccc2)c2cccc3ccc4ccc1n4c23,ClCCl,412.0
O=P1(c2ccccc2)c2cccc3cccc(c23)-c2cccc3cccc1c23,ClCCl,346.0
O=P1(c2ccccc2)c2ccccc2-n2cccc21,ClCCl,290.0
O=P1(c2ccccc2)c2ccccc2N(c2ccccc2)c2ccccc21,ClCCl,344.0
O=P12n3c4c5ccccc5c3/N=C3\N=C(/N=c5/c6ccccc6c(n51)=c1c5ccccc5c(n12)=N4)c1ccccc13,CN(C)C=O,654.0
O=S(=O)(O)Cc1ccccc1,CO,574.0
O=S(=O)(O)c1ccc(Oc2cccc3c2C2=N/C3=N\c3c4c(Oc5ccc(S(=O)(=O)O)cc5)cccc4c4n3[Zn]n3/c(c5cccc(Oc6ccc(S(=O)(=O)O)cc6)c5/c3=N/C3=N/C(=N\4)c4c(Oc5ccc(S(=O)(=O)O)cc5)cccc43)=N\2)cc1,CS(C)=O,695.0
O=S(=O)(O)c1ccc2c(ccc3nn(-c4ccc(-c5nc(-c6ccccc6)c(-c6ccccc6)[nH]5)cc4)nc32)c1,CS(C)=O,363.0
O=S(=O)(O)c1cccc2c1ccc1nn(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)nc12,CS(C)=O,359.0
O=S(=O)([O-])CCCCN1C=C/C(=C/C=C/C=C/c2cc[n+](CCCCS(=O)(=O)[O-])c3ccccc23)c2ccccc21,CO,815.0
O=S(=O)([O-])CCCOc1ccc(C2=[N+]3C(=Nc4c(-c5ccccc5)cc(-c5ccc(OCc6cn([C@H]7[C@H](O)[C@H](O)[C@@H](CO)O[C@H]7O)nn6)cc5)n4[B-]3(F)F)C(c3ccccc3)=C2)cc1,O,688.0
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,C1CCOC1,398.8035892
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,C1COCCO1,398.4222479
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CC1COC(=O)O1,397.6143141
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CCOC(C)=O,398.5175148
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CN(C)C(=O)N(C)C,398.9467805
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CN(C)C=O,398.2318506
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CN(C)P(=O)(N(C)C)N(C)C,401.7677782
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CS(C)=O,400.7855397
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,N#Cc1ccccc1,401.3968611
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,O,454.0
O=S(=O)([O-])c1cc(O)c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,O=C1CCCO1,398.089172
O=S(=O)([O-])c1cc(S(=O)(=O)Cl)ccc1C1=c2cc3c4c(c2Oc2c1cc1c5c2CCCN5CCC1)CCC[N+]=4CCC3,O,589.0
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CC#N,484.9895727
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CC(C)O,474.0010428
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CCO,466.0049397
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,CO,457.9173917
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,NC=O,472.9921483
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,O,460.9994468
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,OCC(F)(F)F,432.9941546
O=S(=O)([O-])c1cc([O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c34,OCCO,462.000462
O=S(=O)([O-])c1ccc(/C=C/c2ccc(-c3nnc(-c4ccc(/C=C/c5ccc(S(=O)(=O)[O-])cc5S(=O)(=O)[O-])cc4)o3)cc2)c(S(=O)(=O)[O-])c1,C1CCOC1,349.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,C1COCCO1,322.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CC#N,322.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CC(C)O,321.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CCCCO,321.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CCO,321.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CCOC(C)=O,322.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CN(C)C=O,324.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CO,321.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,CS(C)=O,325.0
O=S(=O)([O-])c1ccc(O)c2ccccc12,O,319.0
O=S(=O)([O-])c1ccc2c(O)cc(S(=O)(=O)[O-])cc2c1,O,295.0
O=S(=O)([O-])c1ccc2c([O-])cc(S(=O)(=O)[O-])cc2c1,O,350.0
O=S(=O)([O-])c1cccc2c(O)cccc12,O,304.0
O=S(=O)([O-])c1cccc2c([O-])cccc12,O,346.0
O=S(=O)([O-])c1ccccc1-c1c2ccc(N3C4CCC3CC4)cc2[o+]c2cc(N3C4CCC3CC4)ccc12,CO,548.0
O=S(=O)([O-])c1ccccc1/C=C/c1ccc(-c2nnc(-c3ccc(/C=C/c4ccccc4S(=O)(=O)[O-])cc3)o2)cc1,C1CCOC1,346.0
O=S(=O)([O-])c1ccccc1/C=C/c1ccc(-c2nnc(-c3ccc(/C=C/c4ccccc4S(=O)(=O)[O-])cc3)o2)cc1,CC(C)=O,344.0
O=S(=O)([O-])c1ccccc1/C=C/c1ccc(-c2nnc(-c3ccc(/C=C/c4ccccc4S(=O)(=O)[O-])cc3)o2)cc1,CN(C)C=O,348.0
O=S(=O)(c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1)c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,Cc1ccccc1,341.0
O=S(=O)(c1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccc(S(=O)(=O)c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,Cc1ccccc1,354.0
O=S(=O)(c1ccc2c(c1)c1ccccc1n2-c1ccccc1)c1ccc2c(c1)c1ccccc1n2-c1ccccc1,ClCCl,290.0
O=S(=O)(c1cccc(N2N=C(c3ccco3)CC2c2ccccc2)c1)c1cccc(N2N=C(c3ccco3)CC2c2ccccc2)c1,ClCCl,348.0
O=S(=O)(c1cccc(N2N=C(c3cccs3)CC2c2ccccc2)c1)c1cccc(N2N=C(c3cccs3)CC2c2ccccc2)c1,ClCCl,370.0
O=S(=O)(c1cccc(N2c3ccccc3Oc3ccccc32)c1)c1cccc(N2c3ccccc3Oc3ccccc32)c1,C1CCOC1,317.0
O=S(=O)(c1cccc(N2c3ccccc3Oc3ccccc32)c1)c1cccc(N2c3ccccc3Oc3ccccc32)c1,Cc1ccccc1,308.0
O=S(=O)(c1cccc(N2c3ccccc3Oc3ccccc32)c1)c1cccc(N2c3ccccc3Oc3ccccc32)c1,ClC(Cl)Cl,315.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(S(=O)(=O)c5ccccc5)cc4)ccc2n3-c2ccccc2)cc1,CCCCCC,343.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(S(=O)(=O)c5ccccc5)cc4)ccc2n3-c2ccccc2)cc1,CN(C)C=O,345.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(S(=O)(=O)c5ccccc5)cc4)ccc2n3-c2ccccc2)cc1,CO,343.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(S(=O)(=O)c5ccccc5)cc4)ccc2n3-c2ccccc2)cc1,Cc1ccccc1,340.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c(c2)c2cc(-c4ccc(S(=O)(=O)c5ccccc5)cc4)ccc2n3-c2ccccc2)cc1,ClCCl,343.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c4ccc(-c5ccc(S(=O)(=O)c6ccccc6)cc5)cc4n(-c4ccccc4)c3c2)cc1,CCCCCC,334.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c4ccc(-c5ccc(S(=O)(=O)c6ccccc6)cc5)cc4n(-c4ccccc4)c3c2)cc1,CN(C)C=O,341.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c4ccc(-c5ccc(S(=O)(=O)c6ccccc6)cc5)cc4n(-c4ccccc4)c3c2)cc1,CO,336.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c4ccc(-c5ccc(S(=O)(=O)c6ccccc6)cc5)cc4n(-c4ccccc4)c3c2)cc1,Cc1ccccc1,338.0
O=S(=O)(c1ccccc1)c1ccc(-c2ccc3c4ccc(-c5ccc(S(=O)(=O)c6ccccc6)cc5)cc4n(-c4ccccc4)c3c2)cc1,ClCCl,339.0
O=S(=O)(c1ccccc1)c1ccc(-n2c3ccccc3c3c2c2ccccc2n3-c2ccccc2)cc1,Cc1ccccc1,360.0
O=S1(=O)C(c2ccsc2)=C(c2ccsc2)c2ccccc21,C1CCOC1,350.0
O=S1(=O)C2=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc13)c1ccccc12,C1CCOC1,431.0
O=S1(=O)C2=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc13)c1ccccc12,CC#N,430.0
O=S1(=O)C2=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc13)c1ccccc12,CCCCCC,424.0
O=S1(=O)C2=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc13)c1ccccc12,Cc1ccccc1,438.0
O=S1(=O)C2=C(c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc13)c1ccccc12,ClCCl,438.0
O=S1(=O)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(N(c4ccccc4)c4ccccc4)ccc13)c1ccccc12,C1CCOC1,443.0
O=S1(=O)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(N(c4ccccc4)c4ccccc4)ccc13)c1ccccc12,CC#N,446.0
O=S1(=O)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(N(c4ccccc4)c4ccccc4)ccc13)c1ccccc12,CCCCCC,434.0
O=S1(=O)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(N(c4ccccc4)c4ccccc4)ccc13)c1ccccc12,Cc1ccccc1,450.0
O=S1(=O)C2=C(c3ccc(N(c4ccccc4)c4ccccc4)cc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1cc(N(c4ccccc4)c4ccccc4)ccc13)c1ccccc12,ClCCl,451.0
O=S1(=O)C2=C(c3ccccc31)C1(C3=C(c4ccccc41)S(=O)(=O)c1ccccc13)c1ccccc12,ClCCl,360.0
O=S1(=O)C2=C(c3ccccc31)C1(c3ccccc32)c2ccccc2-c2sc3ccccc3c21,ClCCl,360.0
O=S1(=O)c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21,Cc1ccccc1,379.0
O=S1(=O)c2cc(-n3c4ccccc4c4ccccc43)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21,ClC(Cl)Cl,384.0
O=S1(=O)c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2C2(c3ccccc3-c3ccccc32)c2cc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc21,ClCCl,341.0
O=S1(=O)c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2C2(c3ccccc3-c3ccccc32)c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)ccc21,ClCCl,363.0
O=S1(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc2-c2cc(-n3c4ccccc4c4ccccc43)ccc21,Cc1ccccc1,351.0
O=S1(=O)c2ccc(-n3c4ccccc4c4ccccc43)cc2-c2cc(-n3c4ccccc4c4ccccc43)ccc21,ClC(Cl)Cl,354.0
O=S1(=O)c2ccccc2-c2c1c1ccccc1p2-c1ccccc1,C1CCCCC1,349.0
O=S1(=O)c2ccccc2-c2c1c1ccccc1p2-c1ccccc1,CC#N,355.0
O=S1(=O)c2ccccc2-c2c1c1ccccc1p2-c1ccccc1,CCO,356.0
O=S1(=O)c2ccccc2-c2c1c1ccccc1p2-c1ccccc1,ClCCl,357.0
O=S1(=O)c2ccccc2C2(c3cc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)ccc3-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cc32)c2ccccc21,ClCCl,346.0
O=S1(=O)c2ccccc2C2(c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc3-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc32)c2ccccc21,ClCCl,380.0
O=[N+]([O-])C=Cc1ccc(N(c2ccccc2)c2ccc(C=C[N+](=O)[O-])cc2)cc1,CN(C)C=O,456.0
O=[N+]([O-])C=Cc1ccc(N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,438.0
O=[N+]([O-])c1cc(/N=N/c2cc3c4c(c2)CCCN4CCC3)cc([N+](=O)[O-])c1,CCOC(C)=O,513.0
O=[N+]([O-])c1cc(C=C(C#Cc2ccccc2)C#Cc2ccccc2)ccc1C=C(C#Cc1ccccc1)C#Cc1ccccc1,ClC(Cl)Cl,413.0
O=[N+]([O-])c1cc(Cl)ccc1C1=CC2=C(c3ccccc3)c3cc(-c4ccc(Cl)cc4[N+](=O)[O-])cn3[B-](F)(F)[N+]2=C1,ClCCl,537.0
O=[N+]([O-])c1cc(Cl)ccc1C1=CC2=C(c3ccccc3)c3cccn3[B-](F)(F)[N+]2=C1,ClCCl,517.0
O=[N+]([O-])c1cc(O)c(O)cc1CO,C1CCOC1,356.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=C1C=C(c2ccccc2)OC(c2ccccc2)=C1,Cc1ccccc1,684.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=C1N(c2ccccc2)c2ccccc2N1c1ccccc1,Cc1ccccc1,724.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=CC=C1C=C(c2ccccc2)OC(c2ccccc2)=C1,Cc1ccccc1,761.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=CC=C1N(c2ccccc2)c2ccccc2N1c1ccccc1,Cc1ccccc1,790.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=CC=CC=C1C=C(c2ccccc2)OC(c2ccccc2)=C1,Cc1ccccc1,748.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=CC=CC=C1N(c2ccccc2)c2ccccc2N1c1ccccc1,Cc1ccccc1,873.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=CC=c1c2cccc3cccc(c32)n1Cc1ccccc1,Cc1ccccc1,772.0
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=CC=c1c2cccc3cccc(c32)n1Cc1ccccc1,Cc1ccccc1,696.0
O=[N+]([O-])c1cc2c3c([n+]4c(-c5ccccc5)c(-c5ccccc5)c5ccccc5c4c(-c4ccccc4)c3c1)OC(c1ccccc1)=C2c1ccccc1,ClCCl,559.0
O=[N+]([O-])c1cc2c3c([o+]c(-c4ccccc4)c(-c4ccccc4)c3c1)N1C(c3ccccc3)=C(c3ccccc3)c3ccccc3C1=C2c1ccccc1,ClCCl,559.0
O=[N+]([O-])c1cc[nH]c1,CO,270.0
O=[N+]([O-])c1cc[nH]c1,O,280.0
O=[N+]([O-])c1ccc(-c2c3nc(c(-c4ccccc4)c4ccc([nH]4)c(-c4ccccc4)c4nc(c(-c5ccccc5)c5ccc2[nH]5)C=C4)C=C3)cc1,ClCCl,412.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc([N+](=O)[O-])cc5)s4)s3)s2)cc1,C1CCOC1,443.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc([N+](=O)[O-])cc5)s4)s3)s2)cc1,Cc1ccccc1,442.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc([N+](=O)[O-])cc5)s4)s3)s2)cc1,ClC(Cl)Cl,444.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc(-c4ccc(-c5ccc([N+](=O)[O-])cc5)s4)s3)s2)cc1,ClCCl,446.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1,C1CCOC1,387.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1,CN(C)C=O,393.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1,CS(C)=O,396.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1,ClC(Cl)Cl,386.0
O=[N+]([O-])c1ccc(-c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1,ClCCl,388.0
O=[N+]([O-])c1ccc(-c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,346.0
O=[N+]([O-])c1ccc(-c2cnc3cc(O)c(-c4nc5cc([N+](=O)[O-])ccc5[nH]4)cc3c2)cc1,CN(C)C=O,331.0
O=[N+]([O-])c1ccc(-c2cnc3cc(O)c(-c4nc5ccccc5s4)cc3c2)cc1,CC(C)=O,331.0
O=[N+]([O-])c1ccc(-c2nc(/C=C/c3ccccc3)c(/C=C/c3ccccc3)[nH]2)cc1,ClCCl,435.0
O=[N+]([O-])c1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1,ClC(Cl)Cl,350.0
O=[N+]([O-])c1ccc(-c2nnc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)o2)cc1,Cc1ccccc1,375.0
O=[N+]([O-])c1ccc(-c2nnc(N=Nc3ccc(-c4cccs4)s3)s2)cc1,CS(C)=O,565.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cc3ccccc3o2)s1,C1CCOC1,467.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cc3ccccc3o2)s1,CC#N,465.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cc3ccccc3o2)s1,CCCCCC,448.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cc3ccccc3o2)s1,CS(C)=O,478.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cc3ccccc3o2)s1,Cc1ccccc1,464.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cc3ccccc3o2)s1,ClCCl,476.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(-c3ccccc3)cc2)s1,C1CCOC1,468.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(-c3ccccc3)cc2)s1,CC#N,467.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(-c3ccccc3)cc2)s1,CCCCCC,447.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(-c3ccccc3)cc2)s1,CS(C)=O,480.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(-c3ccccc3)cc2)s1,Cc1ccccc1,460.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(-c3ccccc3)cc2)s1,ClCCl,476.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(Br)cc2)s1,C1CCOC1,461.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(Br)cc2)s1,CC#N,464.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(Br)cc2)s1,CCCCCC,439.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(Br)cc2)s1,CS(C)=O,474.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(Br)cc2)s1,Cc1ccccc1,457.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc(Br)cc2)s1,ClCCl,470.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc3ccccc3c2)s1,C1CCOC1,468.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc3ccccc3c2)s1,CC#N,467.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc3ccccc3c2)s1,CCCCCC,433.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc3ccccc3c2)s1,CS(C)=O,480.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc3ccccc3c2)s1,Cc1ccccc1,460.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccc3ccccc3c2)s1,ClCCl,476.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)o1,C1CCOC1,447.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)o1,CC#N,443.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)o1,CCCCCC,426.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)o1,CS(C)=O,459.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)o1,Cc1ccccc1,446.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)o1,ClCCl,459.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,C1CCOC1,460.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CC#N,463.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CCCCCC,439.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,CS(C)=O,483.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,Cc1ccccc1,457.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2ccccc2)s1,ClCCl,470.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cccs2)s1,C1CCOC1,466.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cccs2)s1,CC#N,469.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cccs2)s1,CCCCCC,451.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cccs2)s1,CS(C)=O,480.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cccs2)s1,Cc1ccccc1,465.0
O=[N+]([O-])c1ccc(-c2sc(N(c3ccccc3)c3ccccc3)nc2-c2cccs2)s1,ClCCl,473.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)o1,C1CCOC1,453.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)o1,CC#N,469.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)o1,CCCCCC,429.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)o1,CS(C)=O,474.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)o1,Cc1ccccc1,455.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)o1,ClCCl,478.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)s1,C1CCOC1,476.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)s1,CC#N,480.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)s1,CCCCCC,445.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)s1,CS(C)=O,497.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)s1,Cc1ccccc1,471.0
O=[N+]([O-])c1ccc(-c2sc(N3CCCCC3)nc2-c2ccccc2)s1,ClCCl,487.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccc(Br)cc2)s1,C1CCOC1,455.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccc(Br)cc2)s1,CC#N,466.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccc(Br)cc2)s1,CCCCCC,432.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccc(Br)cc2)s1,CS(C)=O,479.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccc(Br)cc2)s1,Cc1ccccc1,456.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccc(Br)cc2)s1,ClCCl,464.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)o1,C1CCOC1,447.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)o1,CC#N,452.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)o1,CCCCCC,424.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)o1,CS(C)=O,464.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)o1,Cc1ccccc1,447.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)o1,ClCCl,454.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)s1,C1CCOC1,462.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)s1,CC#N,468.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)s1,CCCCCC,433.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)s1,CS(C)=O,483.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)s1,Cc1ccccc1,457.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccccc2)s1,ClCCl,470.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccco2)s1,C1CCOC1,467.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccco2)s1,CC#N,468.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccco2)s1,CCCCCC,435.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccco2)s1,CS(C)=O,486.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccco2)s1,Cc1ccccc1,461.0
O=[N+]([O-])c1ccc(-c2sc(N3CCOCC3)nc2-c2ccco2)s1,ClCCl,476.0
O=[N+]([O-])c1ccc(-c2scc3c2OCCO3)cc1,ClCCl,376.0
O=[N+]([O-])c1ccc(-n2c3ccccc3c3c2c2ccccc2n3-c2ccccc2)cc1,Cc1ccccc1,418.0
O=[N+]([O-])c1ccc(-n2ncc(-c3ccccc3)n2)cc1,CO,336.0
O=[N+]([O-])c1ccc(/C2=C3/N=C(C(c4ccccc4)=C3c3ccccc3)/C(c3ccc([N+](=O)[O-])cc3)=c3\[nH]/c(c(-c4ccccc4)c3-c3ccccc3)=C(/c3ccc([N+](=O)[O-])cc3)C3=N/C(=C(/c4ccc([N+](=O)[O-])cc4)c4[nH]c2c(-c2ccccc2)c4-c2ccccc2)C(c2ccccc2)=C3c2ccccc2)cc1,ClCCl,711.0
O=[N+]([O-])c1ccc(/C=C/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,391.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,C1CCOC1,431.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,C1COCCO1,425.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,CC#N,434.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,CC(C)=O,433.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,CCCCCC,404.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,CCO,429.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,446.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,CO,430.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,COc1ccccc1OC,441.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,CS(C)=O,452.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,424.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)(Cl)Cl,416.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,438.0
O=[N+]([O-])c1ccc(/C=C/N(c2ccccc2)c2ccccc2)cc1,ClCCl,439.0
O=[N+]([O-])c1ccc(/C=C/N2c3ccccc3Oc3ccccc32)cc1,Cc1ccccc1,431.0
O=[N+]([O-])c1ccc(/C=C/c2c[nH]c3ccccc23)cc1,CC#N,410.0
O=[N+]([O-])c1ccc(/C=C/c2c[nH]c3ccccc23)cc1,CCCCCCC,393.0
O=[N+]([O-])c1ccc(/C=C/c2c[nH]c3ccccc23)cc1,CO,413.0
O=[N+]([O-])c1ccc(/C=C/c2c[nH]c3ccccc23)cc1,O,418.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,C1CCCCC1,415.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,C1CCOC1,414.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CC(C)=O,415.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CCCCCC,413.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CCOC(C)=O,407.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CN(C)C=O,423.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,CS(C)=O,428.0
O=[N+]([O-])c1ccc(/C=C/c2ccc(-c3cc4ccccc4s3)s2)cc1,Cc1ccccc1,415.0
O=[N+]([O-])c1ccc(/C=C/c2ccc3ncnc(Nc4ccccc4)c3c2)cc1,ClC(Cl)Cl,372.0
O=[N+]([O-])c1ccc(/C=C/c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)cc1,CC#N,369.0
O=[N+]([O-])c1ccc(/C=C/c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)cc1,CCCCCCC,357.0
O=[N+]([O-])c1ccc(/C=C/c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)cc1,CO,367.0
O=[N+]([O-])c1ccc(/C=C/c2cn(S(=O)(=O)c3ccccc3)c3ccccc23)cc1,O,378.0
O=[N+]([O-])c1ccc(/C=C/c2nc3c4ccccc4c4ccccc4c3o2)cc1,CC#N,410.0
O=[N+]([O-])c1ccc(C#Cc2cc3ccccc3cc2C#Cc2ccc([N+](=O)[O-])cc2)cc1,ClCCl,347.0
O=[N+]([O-])c1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccc([N+](=O)[O-])cc4)s3)s2)cc1,C1CCOC1,411.0
O=[N+]([O-])c1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccc([N+](=O)[O-])cc4)s3)s2)cc1,Cc1ccccc1,413.0
O=[N+]([O-])c1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccc([N+](=O)[O-])cc4)s3)s2)cc1,ClC(Cl)Cl,412.0
O=[N+]([O-])c1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccc([N+](=O)[O-])cc4)s3)s2)cc1,ClCCl,420.0
O=[N+]([O-])c1ccc(C#Cc2ccc(C#Cc3ccc([N+](=O)[O-])cc3)s2)cc1,C1CCOC1,383.0
O=[N+]([O-])c1ccc(C#Cc2ccc(C#Cc3ccc([N+](=O)[O-])cc3)s2)cc1,CN(C)C=O,386.0
O=[N+]([O-])c1ccc(C#Cc2ccc(C#Cc3ccc([N+](=O)[O-])cc3)s2)cc1,CS(C)=O,388.0
O=[N+]([O-])c1ccc(C#Cc2ccc(C#Cc3ccc([N+](=O)[O-])cc3)s2)cc1,ClC(Cl)Cl,390.0
O=[N+]([O-])c1ccc(C#Cc2ccc(C#Cc3ccc([N+](=O)[O-])cc3)s2)cc1,ClCCl,389.0
O=[N+]([O-])c1ccc(C#Cc2ccc([N+](=O)[O-])cc2)cc1,CO,329.0
O=[N+]([O-])c1ccc(C#Cc2ccc([N+](=O)[O-])cc2)cc1,ClCCl,335.0
O=[N+]([O-])c1ccc(C#Cc2ccc3ccc(C#Cc4ccc([N+](=O)[O-])cc4)cc3c2)cc1,ClCCl,347.0
O=[N+]([O-])c1ccc(C#Cc2ccc3ccccc3c2)cc1,ClC(Cl)Cl,338.0
O=[N+]([O-])c1ccc(C#Cc2ccc3ccccc3c2)cc1,ClCCl,339.0
O=[N+]([O-])c1ccc(C#Cc2ccccc2C#Cc2ccc([N+](=O)[O-])cc2)cc1,CC#N,350.0
O=[N+]([O-])c1ccc(C2=C3C=CC=[N+]3[B-](F)(F)n3c2ccc3N2CCOCC2)cc1,ClCCl,496.0
O=[N+]([O-])c1ccc(C=NN=CC=Cc2ccccc2)cc1,C1COCCO1,346.0
O=[N+]([O-])c1ccc(C=NN=Cc2ccco2)cc1,C1COCCO1,341.0
O=[N+]([O-])c1ccc(C=NN=Cc2cccs2)cc1,C1COCCO1,342.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,C1CCCCC1,365.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,C1CCOC1,374.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,C1COCCO1,372.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,CC#N,367.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,CC(C)O,370.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,CCOC(C)=O,371.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,CCOCC,363.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,CO,372.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,Cc1ccccc1,368.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,ClC(Cl)Cl,363.0
O=[N+]([O-])c1ccc(F)cc1C1CC(c2cccc3ccccc23)=NN1c1ccccc1,O,375.0
O=[N+]([O-])c1ccc(N/C=C/C=[NH+]c2ccc([N+](=O)[O-])cc2)cc1,CS(C)=O,388.0
O=[N+]([O-])c1ccc(N=Nc2c(-c3ccccc3)[nH]c3ccccc23)cc1,CO,445.0
O=[N+]([O-])c1ccc(N=Nc2nc3ccc([N+](=O)[O-])cc3s2)cc1,CO,338.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,C1CCCCC1,355.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,C1CCOC1,372.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,CC#N,371.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,CC(C)=O,371.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,CCO,368.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,CN(C)C=O,267.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,CO,369.0
O=[N+]([O-])c1ccc(NCCN(Cc2c3ccccc3cc3ccccc23)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1,ClC(Cl)Cl,355.0
O=[N+]([O-])c1ccc(Nc2ccc3ccccc3n2)cc1,CCO,385.0
O=[N+]([O-])c1ccc(Nc2ccc3ccccc3n2)cc1,CCOC(C)=O,379.0
O=[N+]([O-])c1ccc(Nc2ccc3ccccc3n2)cc1,Cc1ccccc1,373.0
O=[N+]([O-])c1ccc(O)c(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)c1,ClCCl,342.0
O=[N+]([O-])c1ccc(O)c(O)c1,C1CCOC1,349.0
O=[N+]([O-])c1ccc(O)c(O)c1,CO,346.0
O=[N+]([O-])c1ccc(O)c(O)c1,O,423.0
O=[N+]([O-])c1ccc(O)cc1,CO,309.0
O=[N+]([O-])c1ccc(O)cc1,O,401.0
O=[N+]([O-])c1ccc(OCc2nnc(-c3cc(-c4ccc(Cl)cc4)nn3Cc3ccc(Cl)nc3)o2)cc1,ClCCl,263.0
O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(C#Cc3ccc4ccc5ccc(C#Cc6ccc(NS(=O)(=O)c7ccc([N+](=O)[O-])cc7[N+](=O)[O-])cc6)c6ccc3c4c56)cc2)c([N+](=O)[O-])c1,CO,402.0
O=[N+]([O-])c1ccc(S(=O)(=O)c2cnc(N=Nc3ccc(O)c4ncccc34)s2)cc1,CS(C)=O,593.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,C1CCOC1,525.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,CC#N,513.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,CC(C)=O,515.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,Cc1ccccc1,549.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)O5)cc1,ClCCl,553.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,Cc1ccccc1,536.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4c5c(ccc4c3O[B-]2(c2ccccc2)c2ccccc2)C=[N+](c2ccc([N+](=O)[O-])cc2)[B-](c2ccccc2)(c2ccccc2)O5)cc1,ClCCl,541.0
O=[N+]([O-])c1ccc([N+]2=Cc3ccc4ccccc4c3O[B-]2(F)F)cc1,ClCCl,430.0
O=[N+]([O-])c1ccc([N+]2=Cc3cccn3[B-]2(c2ccccc2)c2ccccc2)cc1,C1CCOC1,420.33898305084745
O=[N+]([O-])c1ccc2c(c1)-c1c3c(c4c([n+]1[B-](F)(F)O2)CCc1ccccc1-4)CCc1ccccc1-3,ClCCl,343.0
O=[N+]([O-])c1ccc2nc(-c3ccccc3)cc(-c3ccccc3)c2c1,CCO,335.0
O=[N+]([O-])c1ccc2nc(N=Nc3c(-c4ccccc4)[nH]c4ccccc34)sc2c1,ClC(Cl)Cl,506.0
O=[N+]([O-])c1ccc2nc(N=Nc3ccc(Cl)cc3)sc2c1,CO,355.0
O=[N+]([O-])c1ccc2nc(N=Nc3ccc(F)cc3)sc2c1,CO,352.0
O=[N+]([O-])c1ccc2nc(N=Nc3ccc(I)cc3)sc2c1,CO,371.0
O=[N+]([O-])c1ccc2nc(N=Nc3cccc(CO)c3)sc2c1,CO,352.0
O=[N+]([O-])c1ccc2nc(N=Nc3ccccc3Cl)sc2c1,CO,352.0
O=[N+]([O-])c1ccc2nc3cc4ccccc4cc3c(-c3ccccc3)c2c1,ClCCl,400.0
O=[N+]([O-])c1ccc[nH]1,CO,336.0
O=[N+]([O-])c1ccc[nH]1,O,350.0
O=[N+]([O-])c1cccc(C=NNC(=Cc2ccc3ccccc3n2)c2ccccc2)c1,CCO,425.0
O=[N+]([O-])c1cccc(O)c1,CO,329.0
O=[N+]([O-])c1cccc(O)c1,O,328.0
O=[N+]([O-])c1ccccc1-c1scc2c1OCCO2,ClCCl,345.0
O=[N+]([O-])c1ccccc1/C=C/N(c1ccccc1)c1ccccc1,Cc1ccccc1,412.0
O=[N+]([O-])c1ccccc1C1=CC2=C(c3ccccc3)c3cc(-c4ccccc4[N+](=O)[O-])cn3[B-](F)(F)[N+]2=C1,ClCCl,538.0
O=[N+]([O-])c1ccccc1COc1ccccc1/C=N/N=C/c1ccccc1OCc1ccccc1[N+](=O)[O-],C1CCOC1,343.0
O=[N+]([O-])c1ccccc1O,CO,338.0
O=[N+]([O-])c1ccccc1O,O,411.0
O=[N+]([O-])c1cccs1,CO,308.0
O=[N+]([O-])c1cccs1,O,318.0
O=[S]I,CO,436.0
O=c1[nH][nH]c(=O)c2cc3nc(-c4ccccc4)c(-c4ccccc4)nc3cc12,CN(C)C=O,364.0
O=c1[nH][nH]c(=O)c2cc3nc4c5ccccc5c5ccccc5c4nc3cc12,CN(C)C=O,411.0
O=c1[nH][nH]c2c1cnc1c2c(-c2ccc(Br)cc2)nn1-c1ccccc1,CS(C)=O,384.5
O=c1[nH][nH]c2c1cnc1c2c(-c2ccc(Cl)cc2)nn1-c1ccccc1,CS(C)=O,384.0
O=c1[nH]c(-c2ccc(Cl)cc2)cn2nc(-c3ccc(Cl)cc3)cc12,C1CCOC1,330.0
O=c1[nH]c(-c2ccc(Cl)cc2)cn2nc(-c3ccccc3)cc12,C1CCOC1,331.0
O=c1[nH]c(-c2ccccc2)cn2nc(-c3ccc(Cl)cc3)cc12,C1CCOC1,330.0
O=c1[nH]c(-c2ccccc2)cn2nc(-c3ccccc3)cc12,C1CCOC1,325.0
O=c1[nH]c(=O)c2nc3ccccc3nc2[nH]1,CC#N,372.0
O=c1[nH]c(=O)c2scc([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1,CC#N,296.0
O=c1[nH]c(=O)c2scc([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1,CCOC(C)=O,296.0
O=c1[nH]c(=O)c2scc([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1,CO,294.0
O=c1[nH]c(=O)c2scc([C@H]3C[C@H](O)[C@@H](CO)O3)c2[nH]1,O,294.0
O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ccsc12,CC#N,294.0
O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ccsc12,CCOC(C)=O,296.0
O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ccsc12,CO,294.0
O=c1[nH]c(=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ccsc12,O,292.0
O=c1[nH]c2[n+](c3ccccc13)[B-](F)(F)Oc1ccccc1-2,CC#N,343.0
O=c1[nH]c2[n+](c3ccccc13)[B-](F)(F)Oc1ccccc1-2,Cc1ccccc1,354.0
O=c1[nH]c2ccccc2[nH]1,C1CCOC1,291.0022116
O=c1[nH]c2ccccc2[nH]1,CC#N,281.0014893
O=c1[nH]c2ccccc2[nH]1,CC(C)=O,284.99772
O=c1[nH]c2ccccc2[nH]1,CCCCCCC,291.9963792
O=c1[nH]c2ccccc2[nH]1,CCCCCl,287.0016933
O=c1[nH]c2ccccc2[nH]1,CCCCO,280.00224
O=c1[nH]c2ccccc2[nH]1,CCCO,280.00224
O=c1[nH]c2ccccc2[nH]1,CCCOCCC,280.00224
O=c1[nH]c2ccccc2[nH]1,CCO,280.00224
O=c1[nH]cc(F)c(=O)[nH]1,CC#N,264.0
O=c1[nH]n(-c2ccccc2)c2c1cnc1c2c(-c2ccc(Br)cc2)nn1-c1ccccc1,CS(C)=O,370.0
O=c1[nH]n(-c2ccccc2)c2c1cnc1c2c(-c2ccc(Cl)cc2)nn1-c1ccccc1,CS(C)=O,369.0
O=c1[nH]nc(-c2ccc(/C=C/c3ccc(-c4n[nH]c(=O)o4)cc3)cc2)o1,CN(C)C=O,334.0
O=c1c(-c2ccc(Br)cc2)coc2cc(O)ccc12,O,287.0
O=c1c(-c2ccc(Cl)cc2)coc2cc(O)ccc12,O,286.0
O=c1c(-c2ccc(F)cc2)coc2cc(O)ccc12,O,287.0
O=c1c(-c2ccc(O)cc2)coc2cc(O)ccc12,O,311.0
O=c1c(-c2cccc(Cl)c2)coc2cc(O)ccc12,O,337.0
O=c1c(-c2cccc(O)c2)coc2cc(O)ccc12,O,287.0
O=c1c(-c2cccc3ccccc23)coc2cc(O)ccc12,O,288.0
O=c1c(-c2ccccc2)coc2cc(O)ccc12,O,336.0
O=c1c(-c2ccccc2Cl)coc2cc(O)ccc12,O,338.0
O=c1c(C2CCCCC2)coc2cc(O)ccc12,O,334.0
O=c1c(CCCCBr)coc2cc(O)ccc12,O,336.0
O=c1c(CCc2ccccc2)coc2cc(O)ccc12,O,332.0
O=c1c(Cc2ccccc2)coc2cc(O)ccc12,O,335.0
O=c1c(N(c2ccccc2)c2ccc3ccccc3c2)c([O-])/c1=[N+](\c1ccccc1)c1ccc2ccccc2c1,CN(C)C=O,423.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,C1CCOC1,401.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CC#N,390.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CC(C)=O,398.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CCO,393.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CCOCC,400.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CN(C)C=O,393.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CN1CCCC1=O,393.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CO,390.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,CS(C)=O,378.0
O=c1c(Nc2ccccc2)c([O-])c1=[NH+]c1ccccc1,O,374.0
O=c1c(O)c(-c2ccc(O)cc2)c1=O,CO,335.0
O=c1c(O)c(-c2ccccc2)oc2ccccc12,O,346.0
O=c1c2cc(-n3c4ccccc4c4ccccc43)ccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,C1CCOC1,408.0
O=c1c2cc(-n3c4ccccc4c4ccccc43)ccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,CCCCCC,408.0
O=c1c2cc(-n3c4ccccc4c4ccccc43)ccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,Cc1ccccc1,408.0
O=c1c2cc(-n3c4ccccc4c4ccccc43)ccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,ClC(Cl)Cl,408.0
O=c1c2cc(-n3c4ccccc4c4ccccc43)ccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,ClCCl,408.0
O=c1c2cc(Br)ccc2nc2n1[B-](F)(F)[n+]1ccccc1-2,CC#N,343.0
O=c1c2cc(Br)ccc2nc2n1[B-](F)(F)[n+]1ccccc1-2,ClCCl,358.0
O=c1c2cc(C#Cc3ccc(Cl)cc3)ccc2nc2ccc(C#Cc3ccc(Cl)cc3)cn12,ClCCl,382.0
O=c1c2cc(Cl)ccc2[nH]c2ccc(COO)cc12,O,415.0
O=c1c2cc(F)c(N3CCCCC3)cc2oc2cc(N3CCCCC3)c(F)cc12,CCO,369.0
O=c1c2cc(F)c(N3CCCCC3)cc2sc2cc(N3CCCCC3)c(F)cc12,CCO,377.0
O=c1c2cc(F)c(N3CCOCC3)cc2oc2cc(N3CCOCC3)c(F)cc12,CCO,344.0
O=c1c2cc(F)c(N3CCOCC3)cc2sc2cc(N3CCOCC3)c(F)cc12,CCO,361.0
O=c1c2cc(F)c(O)cc2n(Cc2ccccc2)c2cc(O)c(F)cc12,CCO,381.0
O=c1c2cc(F)c(O)cc2oc2cc(N3CCCCC3)c(F)cc12,CCO,373.0
O=c1c2cc(F)c(O)cc2oc2cc(O)c(F)cc12,CCO,369.0
O=c1c2cc(F)c(O)cc2sc2cc(O)c(F)cc12,CCO,377.0
O=c1c2cc(F)ccc2nc2n1[B-](F)(F)[n+]1ccccc1-2,CC#N,337.0
O=c1c2cc(F)ccc2nc2n1[B-](F)(F)[n+]1ccccc1-2,ClCCl,350.0
O=c1c2cc(I)ccc2nc2n1[B-](F)(F)[n+]1ccccc1-2,CC#N,345.0
O=c1c2cc(I)ccc2nc2n1[B-](F)(F)[n+]1ccccc1-2,ClCCl,362.0
O=c1c2cc(S(=O)(=O)Cl)ccc2[nH]c2ccc(S(=O)(=O)Cl)cc12,CS(C)=O,399.0
O=c1c2cc3[nH]c4c(S(=O)(=O)O)cc(S(=O)(=O)O)cc4c(=O)c3cc2[nH]c2c(S(=O)(=O)O)cc(S(=O)(=O)O)cc12,O,517.0
O=c1c2cc3ccc4cccc5ccc(c2c(=O)n1-c1ccccc1)c3c45,ClC(Cl)Cl,431.0
O=c1c2ccc(N3CCCCC3)cc2oc2cc(N3CCCCC3)ccc12,CO,382.0377358
O=c1c2ccc(N3CCCCC3)cc2oc2cc(N3CCCCC3)ccc12,ClCCl,371.7842324
O=c1c2cccc3cccc(c32)c2nc3cccc4cccc(c43)n12,ClCCl,475.0
O=c1c2cccc3cccc(c32)c2nc3ccccc3n12,CCO,605.0
O=c1c2cccc3cccc(c32)c2nc3ccccc3n12,ClCCl,384.0
O=c1c2ccccc2[nH]c2ccccc12,CS(C)=O,398.0
O=c1c2ccccc2[nH]c2ccccc12,O,385.0
O=c1c2ccccc2c2c(C#C[Si](c3ccccc3)(c3ccccc3)c3ccccc3)c3c(=O)c4ccccc4c3c(C#C[Si](c3ccccc3)(c3ccccc3)c3ccccc3)c12,ClC(Cl)Cl,520.0
O=c1c2ccccc2n(-c2ccc(-c3ccc(-n4c5ccccc5c(=O)c5ccccc54)cc3)cc2)c2ccccc12,ClCCl,394.0
O=c1c2ccccc2n(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)c2ccccc12,ClCCl,394.0
O=c1c2ccccc2n(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc12,ClCCl,394.0
O=c1c2ccccc2n2c3ccc(-c4ccccc4)cc3c(=O)c3cccc1c32,CC#N,442.0
O=c1c2ccccc2n2c3ccc(-c4ccccc4)cc3c(=O)c3cccc1c32,CCCCCC,434.0
O=c1c2ccccc2n2c3ccc(-c4ccccc4)cc3c(=O)c3cccc1c32,CCCCOCCCC,437.0
O=c1c2ccccc2n2c3ccc(-c4ccccc4)cc3c(=O)c3cccc1c32,CCOC(C)=O,439.0
O=c1c2ccccc2n2c3ccc(-c4ccccc4)cc3c(=O)c3cccc1c32,CN(C)C=O,445.0
O=c1c2ccccc2n2c3ccccc3c(=O)c3cc(-c4ccccc4)cc1c32,CC#N,447.0
O=c1c2ccccc2n2c3ccccc3c(=O)c3cc(-c4ccccc4)cc1c32,CCCCCC,437.0
O=c1c2ccccc2n2c3ccccc3c(=O)c3cc(-c4ccccc4)cc1c32,CCCCOCCCC,440.0
O=c1c2ccccc2n2c3ccccc3c(=O)c3cc(-c4ccccc4)cc1c32,CCOC(C)=O,443.0
O=c1c2ccccc2n2c3ccccc3c(=O)c3cc(-c4ccccc4)cc1c32,CN(C)C=O,450.0
O=c1c2ccccc2n2c3ccccc3c(=O)c3cc(-c4ccccc4)cc1c32,Cc1ccccc1,445.7648546
O=c1c2ccccc2n2c3ccccc3c(=O)c3cccc1c32,Cc1ccccc1,432.9648895
O=c1c2ccccc2nc2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)cc3)cn12,ClCCl,362.0
O=c1c2ccccc2nc2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cn12,ClCCl,355.0
O=c1c2ccccc2nc2ccccn12,ClCCl,354.0
O=c1c2ccccc2oc2ccccc12,CCOC(C)=O,633.0
O=c1c2ccccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,C1CCOC1,388.0
O=c1c2ccccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,CCCCCC,388.0
O=c1c2ccccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,Cc1ccccc1,388.0
O=c1c2ccccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,ClC(Cl)Cl,388.0
O=c1c2ccccc2sc2ccc(-n3c4ccccc4c4ccccc43)cc12,ClCCl,388.0
O=c1c2ccccc2sc2ccccc12,CC(C)O,377.0
O=c1c2ccccc2sc2ccccc12,CCOC(C)=O,635.0
O=c1c2ccccc2sc2ccccc12,CO,378.0
O=c1c2ccccc2sc2ccccc12,OCCO,382.0
O=c1c2ccccc2sc2ccccc12,c1ccccc1,380.0
O=c1cc(-c2cc(-c3cc4c(ccc5ccccc54)oc3=O)nc(-c3cc4c(ccc5ccccc54)oc3=O)c2)c2ccc3ccccc3c2o1,Clc1ccccc1,380.0
O=c1cc(-c2cc(-c3cc4ccccc4oc3=O)nc(-c3cc4ccccc4oc3=O)c2)c2ccc3ccccc3c2o1,Clc1ccccc1,350.0
O=c1cc(-c2nc3ccccn3c2NC2CCCCC2)occ1OCc1ccccc1,ClCCl,357.0
O=c1cc(C(F)(F)F)c2cc3c4c(c2o1)CCCN4CCC3,C1CCCCC1,393.0
O=c1cc(C(F)(F)F)c2cc3c4c(c2o1)CCCN4CCC3,CC#N,418.0
O=c1cc(C(F)(F)F)c2cc3c4c(c2o1)CCCN4CCC3,CCO,421.0
O=c1cc(C(F)(F)F)c2cc3c4c(c2o1)CCCN4CCC3,CCOC(C)=O,409.0
O=c1cc(C(F)(F)F)c2cc3c4c(c2o1)CCCN4CCC3,OCC(O)CO,434.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,C1CCOC1,349.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,C1COCCO1,348.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CC#N,348.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CC(C)=O,349.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CCCCO,350.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CCCO,350.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CCO,350.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CCOC(C)=O,348.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CN(C)C=O,350.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,CO,348.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,Cc1ccccc1,350.0
O=c1cc(COc2ccc(I)cc2)c2c(ccc3ccccc32)o1,ClCCl,349.0
O=c1cc(O)c2ccccc2n1-c1ccccc1,CO,400.0
O=c1cc2c(-c3c(O)c4cccc5ccc6oc(=O)cc3c6c54)c(O)c3cccc4ccc(o1)c2c43,CC1CCCO1,486.0
O=c1cc2c(S(=O)(=O)O)c(O)c3cccc4ccc(o1)c2c43,CC1CCCO1,466.0
O=c1cc2cc(O)c3c(O)ccc4ccc(o1)c2c43,CC1CCCO1,475.0
O=c1cc2cc(O)c3cccc4ccc(o1)c2c43,CC1CCCO1,469.0
O=c1cc[nH]c(=O)[nH]1,CC#N,256.0
O=c1ccc(-c2cccc(Cl)c2)nn1-c1cccs1,CS(C)=O,381.0
O=c1ccc(-c2cccc(Cl)c2)nn1-c1ccnc2ccccc12,CS(C)=O,304.0
O=c1ccc(-c2cccc(Cl)c2)nn1-c1cnc2ccccc2c1,CS(C)=O,304.0
O=c1ccc(-c2cccc(Cl)c2)nn1-c1nc2ccccc2s1,CS(C)=O,363.0
O=c1ccc(-c2ccccc2)nn1-c1nc2ccccc2s1,CS(C)=O,366.0
O=c1ccc2cc3c(cc2o1)OCC3,CC(C)O,333.0
O=c1ccc2cc3c(cc2o1)OCC3,CCO,333.0
O=c1ccc2cc3c(cc2o1)OCC3,CCOCC,330.0
O=c1ccc2cc3c(cc2o1)OCC3,CO,333.0
O=c1ccc2cc3c(cc2o1)OCC3,O,336.0
O=c1ccc2cc3ccoc3cc2o1,CC(C)O,298.0
O=c1ccc2cc3ccoc3cc2o1,CCO,299.0
O=c1ccc2cc3ccoc3cc2o1,CCOCC,294.0
O=c1ccc2cc3ccoc3cc2o1,CO,300.0
O=c1ccc2cc3ccoc3cc2o1,O,303.0
O=c1ccc2ccc(C#Cc3ccccc3)cc2o1,CC#N,300.0
O=c1ccc2ccccc2o1,O,306.0
O=c1cccc2n1CN1C=C(Br)C=CC1=N2,CO,436.0
O=c1cccc2n1C[C@@H]1CNC[C@H]2C1,CC#N,318.0
O=c1ccoc2cc(O)ccc12,O,330.0
O=c1nc(-c2ccccc2)c2c(=O)nc(-c3ccccc3)c1=2,CCO,502.0
O=c1nc2c(-c3ccccc3)c(-c3ccccc3)nc-2c1=O,Cc1ccccc1,533.0
O=c1oc2c(ccc3cc(O)ccc32)nc1-c1ccccc1,c1ccccc1,406.0
O=c1oc2c(ccc3ccccc32)nc1-c1ccccc1,CC#N,396.0
O=c1oc2c(ccc3ccccc32)nc1-c1ccccc1,CCCCCC,398.0
O=c1oc2c(ccc3ccccc32)nc1-c1ccccc1,CO,396.0
O=c1oc2c(ccc3ccccc32)nc1-c1ccccc1,c1ccccc1,396.0
O=c1oc2cc(S(=O)(=O)O)c3ccccc3c2nc1-c1ccccc1,CC#N,398.0
O=c1oc2cc3ccccc3cc2nc1-c1ccccc1,CC#N,348.0
O=c1oc2cc3ccccc3cc2nc1-c1ccccc1,CCCCCC,350.0
O=c1oc2cc3ccccc3cc2nc1-c1ccccc1,CO,346.0
O=c1oc2cc3ccccc3cc2nc1-c1ccccc1,c1ccccc1,356.0
O=c1oc2ccc(Cl)cc2cc1-c1cc2cc(Cl)ccc2o1,CC#N,369.0
O=c1oc2ccc(Cl)cc2cc1-c1cc2cc(Cl)ccc2o1,CCOC(C)=O,370.0
O=c1oc2ccc(Cl)cc2cc1-c1cc2cc(Cl)ccc2o1,CS(C)=O,373.0
O=c1oc2ccc(Cl)cc2cc1-c1cc2cc(Cl)ccc2o1,Cc1ccccc1,375.0
O=c1oc2ccc(Cl)cc2cc1-c1cc2cc(Cl)ccc2o1,O,327.0
O=c1oc2ccc3ccc(O)cc3c2nc1-c1ccccc1,c1ccccc1,406.0
O=c1oc2ccc3cccc4c(O)c(Cl)c(c1Cl)c2c34,CC1CCCO1,478.0
O=c1oc2ccc3ccccc3c2nc1-c1ccc(Cl)cc1,c1ccccc1,404.0
O=c1oc2ccc3ccccc3c2nc1-c1ccccc1,CC#N,392.0
O=c1oc2ccc3ccccc3c2nc1-c1ccccc1,CCCCCC,392.0
O=c1oc2ccc3ccccc3c2nc1-c1ccccc1,CO,394.0
O=c1oc2ccc3ccccc3c2nc1-c1ccccc1,c1ccccc1,398.0
O=c1oc2cccc3c4cccc5ccc6c7cc(F)ccc7c1c(c23)c6c54,C1CCOC1,411.0
O=c1oc2cccc3c4cccc5ccc6c7ccccc7c1c(c23)c6c54,C1CCOC1,409.0
O=c1oc2ccccc2c(O)c1N=Nc1ccccn1,CO,293.0
O=c1oc2ccccc2c(O)c1N=Nc1nc(-c2ccccc2)cs1,CCO,293.0
O=c1oc2ccccc2c(O)c1N=Nc1nnc[nH]1,CCO,296.0
O=c1oc2ccccc2c2c1c(=O)oc1cc(O)cc(O)c12,CS(C)=O,388.0
O=c1oc2ccccc2c2c1c(=O)oc1cc(O)cc(O)c12,ClCCl,385.0
O=c1oc2ccccc2c2c1c(=O)oc1cc(O)ccc12,CS(C)=O,376.0
O=c1oc2ccccc2c2c1c(=O)oc1cc(O)ccc12,ClCCl,374.0
O=c1oc2ccccc2c2c1c(=O)oc1ccc3ccc(O)cc3c12,CS(C)=O,428.0
O=c1oc2ccccc2c2c1c(=O)oc1ccc3ccc(O)cc3c12,ClCCl,428.0
O=c1oc2ccccc2c2cc(N3c4ccccc4Oc4ccccc43)ccc12,Cc1ccccc1,395.0
O=c1oc2ccccc2cc1-c1ccc(-c2ccc(-c3cc4ccccc4oc3=O)cc2)cc1,ClCCl,341.0
O=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,C1CCOC1,331.0
O=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,CC#N,336.0
O=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,CS(C)=O,344.0
O=c1oc2ccccc2cc1-c1ccc([N+](=O)[O-])cc1,ClC(Cl)Cl,341.0
O=c1oc2ccccc2cc1-c1cccc(-c2cc3ccccc3oc2=O)c1,ClC(Cl)Cl,330.0
O=c1oc2ccccc2cc1-c1cn2ccccc2n1,ClC(Cl)Cl,349.0
O=c1oc2ccccc2cc1-c1csc(N=Nc2c(-c3ccccc3)[nH]c3ccccc23)n1,CS(C)=O,500.0
O=c1oc2ccccc2cc1-c1csc(N=Nc2ccc(Nc3ccccc3)cc2)n1,CS(C)=O,512.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,C1CCOC1,354.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,C1COCCO1,357.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CC#N,352.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CC(C)=O,352.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CC(C)CO,353.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CC(C)O,354.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CC1CCCCC1,356.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CCOC(C)=O,352.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CN(C)C=O,352.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CO,352.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,CS(C)=O,354.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,Cc1ccccc1,360.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,ClC(Cl)(Cl)Cl,360.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,ClC(Cl)Cl,356.0
O=c1oc2ccccc2cc1-c1nc2ccccc2o1,OCCO,354.0
O=c1oc2ccccc2cc1/C=C/c1ccccc1,CC#N,351.0
O=c1oc2ccccc2cc1C#Cc1ccccc1,CC#N,342.0
O=c1oc2ccccc2nc1-c1ccc(Cl)cc1,c1ccccc1,344.0
O=c1oc2ccccc2nc1-c1ccccc1,c1ccccc1,332.0
OB(O)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCCCC1,332.8
OB(O)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,C1CCOC1,331.0
OB(O)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CCO,329.6
OB(O)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CCOCC,330.0
OB(O)c1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,CO,326.0
OB1c2ccccc2Nc2ccccc21,ClCCl,366.0
OC(C(F)(F)F)C(F)(F)F,c1ccncc1,823.0
OC(COc1ccccc1C=NNC(=S)Nc1ccc(Br)cc1)COc1ccccc1C=NNC(=S)Nc1ccc(Br)cc1,ClCCl,313.0
OC1(c2ccc(-c3cccs3)s2)CCCC1,C1CCOC1,344.0
OC1(c2ccc(-c3cccs3)s2)CCCC1,CC#N,343.0
OC1(c2ccc(-c3cccs3)s2)CCCC1,CCCCCC,341.0
OC1(c2ccc(-c3cccs3)s2)CCCC1,CCO,342.0
OC1(c2ccc(-c3cccs3)s2)CCCC1,OCCOCCO,347.0
OC1(c2ccc(-c3cccs3)s2)CCCC1,c1ccncc1,348.0
OC1c2ccccc2C=Cc2ccccc21,CCOC(C)=O,423.0
OCCCCc1ccc2ccc3cccc4ccc1c2c34,CO,341.0
OCCN(CCO)c1ccc(N=Nc2nc(-c3ccc(Cl)cc3Cl)cs2)c(Cl)c1,CN(C)C=O,600.0
OCCO,CCCO,681.0
OCCOc1ccc2c(c1)c1cccc3cnc2n31,CO,438.0
OCCSc1c(F)c(F)c(-c2c3nc(c(-c4c(F)c(F)c(F)c(F)c4F)c4ccc([nH]4)c(-c4c(F)c(F)c(SCCO)c(F)c4F)c4nc(c(-c5c(F)c(F)c(F)c(F)c5F)c5ccc2[nH]5)C=C4)C=C3)c(F)c1F,CS(C)=O,413.5
OCCSc1c(F)c(F)c(-c2c3nc(c(-c4c(F)c(F)c(SCCO)c(F)c4F)c4ccc([nH]4)c(-c4c(F)c(F)c(F)c(F)c4F)c4nc(c(-c5c(F)c(F)c(F)c(F)c5F)c5ccc2[nH]5)C=C4)C=C3)c(F)c1F,CS(C)=O,413.0
OCOc1c2ccccc2cc2ccccc12,CC#N,372.0
OC[C@H](O)CNc1ncnc2[nH]c(-c3ccccc3)c(-c3ccccc3)c12,C1CCOC1,470.0
OCc1cc(/N=N/c2ccc(-c3c4ccccc4cc4ccccc34)cc2F)ccc1O,CS(C)=O,405.0
OCc1cc(/N=N/c2ccc(-c3ccc4ccccc4c3)cc2F)ccc1O,CS(C)=O,392.0
OCc1cc(/N=N/c2ccc(-c3cccs3)cc2F)ccc1O,CS(C)=O,399.0
OCc1cc(/N=N\c2ccc(-c3ccc4ccccc4c3)cc2F)ccc1O,CS(C)=O,312.0
OCc1cc(/N=N\c2ccc(-c3cccs3)cc2F)ccc1O,CS(C)=O,321.0
OCc1cc(/N=N\c2ccc(C#Cc3ccc4ccc5cccc6ccc3c4c56)cc2F)ccc1O,CS(C)=O,386.0
OCc1cc2c(cc3ccc4cccc5ccc2c3c45)[nH]1,CCOC(C)=O,388.0
OCc1ccc(/C=c2\o/c(=C\c3ccc(N4CCCCC4)cc3)c3ccccc23)cc1,ClCCl,400.0
OCc1ccc2ccc3cccc4ccc1c2c34,Cc1ccccc1,316.0
OF,CC#N,589.0
ON=C1c2ccccc2-c2ccccc21,CN(C)C=O,318.0
O[Si](c1c2ccccc2cc2ccccc12)(c1c2ccccc2cc2ccccc12)c1c2ccccc2cc2ccccc12,ClC(Cl)Cl,402.0
Oc1c(-c2ccco2)cccc1-c1nc2ccccc2s1,ClCCl,360.0
Oc1c(-c2ccco2)cccc1-c1nc2ccccc2s1,O,360.0
Oc1c(-c2cccs2)cccc1-c1nc2ccccc2s1,ClCCl,356.0
Oc1c(-c2cccs2)cccc1-c1nc2ccccc2s1,O,346.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)cc2c3c1CCCN3CCC2,C1CCOC1,367.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)cc2c3c1CCCN3CCC2,CC#N,371.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)cc2c3c1CCCN3CCC2,CCCCCC,376.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)cc2c3c1CCCN3CCC2,CO,366.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)cc2c3c1CCCN3CCC2,CS(C)=O,373.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)cc2c3c1CCCN3CCC2,Cc1ccccc1,381.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)cc2c3c1CCCN3CCC2,ClCCl,371.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)ccc2c1c1ccccc1n2-c1ccccc1,C1CCOC1,392.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)ccc2c1c1ccccc1n2-c1ccccc1,CC#N,389.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)ccc2c1c1ccccc1n2-c1ccccc1,CCCCCC,391.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)ccc2c1c1ccccc1n2-c1ccccc1,CO,388.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)ccc2c1c1ccccc1n2-c1ccccc1,CS(C)=O,394.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)ccc2c1c1ccccc1n2-c1ccccc1,Cc1ccccc1,394.0
Oc1c(-c2nc3c4ccc(-c5ccccc5)cc4c4cc(-c5ccccc5)ccc4c3[nH]2)ccc2c1c1ccccc1n2-c1ccccc1,ClCCl,393.0
Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc2c3c1CCCN3CCC2,C1CCOC1,367.0
Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc2c3c1CCCN3CCC2,CC#N,365.0
Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc2c3c1CCCN3CCC2,CCCCCC,364.0
Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc2c3c1CCCN3CCC2,CO,365.0
Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc2c3c1CCCN3CCC2,CS(C)=O,368.0
Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc2c3c1CCCN3CCC2,Cc1ccccc1,369.0
Oc1c(-c2nc3c4ccccc4c4ccccc4c3[nH]2)cc2c3c1CCCN3CCC2,ClCCl,367.0
Oc1c(-c2nc3ccccc3s2)cc(-c2nc3ccccc3s2)cc1-c1nc2ccccc2s1,CCCCCC,480.0
Oc1c(Cl)cc(Cl)cc1C=NN=Cc1ccc2ccc3cccc4ccc1c2c34,CC#N,387.0
Oc1c(Cl)cc(Cl)cc1C=Nc1nc2ccccc2s1,CO,270.0
Oc1c2cccc1Cc1cccc(c1O)Cc1cccc(c1O)Cc1cccc(c1O)C2,CN(C)C=O,491.0
Oc1cc(-c2ccco2)ccc1-c1nc2ccccc2s1,ClCCl,361.0
Oc1cc(-c2ccco2)ccc1-c1nc2ccccc2s1,O,354.0
Oc1cc(-c2cccs2)ccc1-c1nc2ccccc2s1,ClCCl,364.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc3c2[nH]1,C1CCOC1,398.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc3c2[nH]1,CC#N,395.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc3c2[nH]1,CCCCCC,397.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc3c2[nH]1,CO,395.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc3c2[nH]1,CS(C)=O,399.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc3c2[nH]1,Cc1ccccc1,400.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccc(-c4ccccc4)cc3c3cc(-c4ccccc4)ccc3c2[nH]1,ClCCl,400.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1,C1CCOC1,386.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1,CC#N,383.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1,CCCCCC,385.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1,CO,383.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1,CS(C)=O,388.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1,Cc1ccccc1,390.0
Oc1cc(N(c2ccccc2)c2ccccc2)ccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1,ClCCl,389.0
Oc1cc2ccc3cc(O)cc4ccc(c1)c2c34,CO,381.0
Oc1ccc(-c2c3nc(c(-c4ccc(O)cc4)c4ccc([nH]4)c(-c4ccc(O)cc4)c4nc(c(-c5ccc(O)cc5)c5ccc2[nH]5)C=C4)C=C3)cc1,CN(C)C=O,653.0
Oc1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1-c1ncc(-c2ccccc2)o1,Cc1ccccc1,315.0
Oc1ccc(-c2cccs2)cc1-c1nc2ccccc2s1,CCO,360.0
Oc1ccc(-c2cccs2)cc1-c1nc2ccccc2s1,O,361.0
Oc1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)cc1,CO,295.0
Oc1ccc(-c2nc3c(c4c2-c2ccc(Br)cc2CC4)-c2ccc(Br)cc2CC3)cc1,ClC(Cl)Cl,367.0
Oc1ccc(-c2nc3c(o2)c(-c2nc4ccccc4s2)cc2ccccc23)c(O)c1,CN(C)C=O,322.0
Oc1ccc(-c2nc3ccccc3[nH]2)c(O)c1,O,326.0
Oc1ccc(-n2cccc2)cc1,ClC(Cl)Cl,325.0
Oc1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(O)c(O)c3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(O)c(O)c2)=C2/C=CC(=N2)/C=4c2ccc(O)c(O)c2)cc1O,CCO,428.0
Oc1ccc(/C2=C3\C=CC(=N3)/C(c3ccccc3)=c3/cc/c4n3[Zn]n3c(ccc32)/C(c2ccccc2)=C2/C=CC(=N2)/C=4c2ccccc2)c2cccnc12,ClCCl,423.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,C1CCCCC1,348.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,C1COCCO1,341.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CC#N,350.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CC(C)=O,342.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CC(C)CO,344.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CC(C)O,344.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CCCCC,341.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CCCCCC,346.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CCCCO,346.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CCCCOC(C)=O,346.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CCCO,345.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CCOC(C)=O,340.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CCOCC,345.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CN(C)C=O,345.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CO,342.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,CS(C)=O,348.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,Cc1ccccc1,342.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,Cc1ccccc1C,382.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,ClC(Cl)Cl,343.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,N#Cc1ccccc1,341.0
Oc1ccc(/N=C/c2ccccc2Oc2ccccc2)cc1,c1ccccc1,345.0
Oc1ccc(Br)cc1-c1nc2c(c3c1-c1ccccc1CC3)-c1ccccc1CC2,ClCCl,345.0
Oc1ccc(Br)cc1-c1nc2ncccc2o1,CO,341.0
Oc1ccc(C2=[N+]3C(=C(c4ccccc4)c4cccn4[B-]3(F)F)C=C2)cc1,ClC(Cl)Cl,541.0
Oc1ccc(C=Cc2cc(O)cc(O)c2)cc1,O,310.0
Oc1ccc(C=Nc2ccccc2)cc1,CCO,293.0
Oc1ccc(Cl)cc1/C=N/N=C/c1cc(Cl)ccc1O,C1CCOC1,367.0
Oc1ccc(N(c2ccccc2)c2ccccc2)cc1O,C1CCOC1,298.0
Oc1ccc(N=NC2=CC=C3N=[N+](c4ccc(O)cc4)[B-](F)(F)C23)cc1,C1CCOC1,586.0
Oc1ccc(N=NN2NC=CS2)c2cccnc12,CS(C)=O,547.0
Oc1ccc(N=Nc2ccc(Oc3ccccc3)cc2)c2cccnc12,CS(C)=O,407.0
Oc1ccc(N=Nc2ccccc2)c2cccnc12,CS(C)=O,396.0
Oc1ccc(N=Nc2cccnc2)c2cccnc12,CS(C)=O,538.0
Oc1ccc(N=Nc2nc(-c3ccc(Br)cc3)cs2)c2cccnc12,CS(C)=O,570.0
Oc1ccc(N=Nc2nc(-c3ccccc3)cs2)c2cccnc12,CS(C)=O,570.0
Oc1ccc(N=Nc2nc3ccc(Cl)cc3s2)c2cccnc12,CS(C)=O,564.0
Oc1ccc(N=Nc2nc3ccccc3[nH]2)c2cccnc12,CS(C)=O,558.0
Oc1ccc(N=Nc2nc3ccccc3s2)c2cccnc12,CS(C)=O,489.0
Oc1ccc(N=Nc2nccs2)c2cccnc12,CS(C)=O,443.0
Oc1ccc(N=Nn2cc(S)nn2)c2cccnc12,CO,496.0
Oc1ccc(Nc2ccc3ccccc3n2)cc1,CCO,361.0
Oc1ccc(Nc2ccc3ccccc3n2)cc1,CCOC(C)=O,359.0
Oc1ccc(Nc2ccc3ccccc3n2)cc1,Cc1ccccc1,354.0
Oc1ccc(OCc2ccccc2)cc1N=Nc1nccs1,CN(C)C=O,621.0
Oc1ccc2ccc3cccc4ccc1c2c34,Brc1ccccc1,384.4675125
Oc1ccc2ccc3cccc4ccc1c2c34,C1CCCCC1,382.1607368
Oc1ccc2ccc3cccc4ccc1c2c34,C1CCOC1,385.252533
Oc1ccc2ccc3cccc4ccc1c2c34,C1COCCO1,384.6005923
Oc1ccc2ccc3cccc4ccc1c2c34,CC1COC(=O)O1,384.3788438
Oc1ccc2ccc3cccc4ccc1c2c34,CCOC(C)=O,384.0245776
Oc1ccc2ccc3cccc4ccc1c2c34,CN(C)C(=O)N(C)C,386.6527472
Oc1ccc2ccc3cccc4ccc1c2c34,CN(C)C=O,386.3838337
Oc1ccc2ccc3cccc4ccc1c2c34,CN(C)P(=O)(N(C)C)N(C)C,388.3344336
Oc1ccc2ccc3cccc4ccc1c2c34,CS(C)=O,387.7020897
Oc1ccc2ccc3cccc4ccc1c2c34,Cc1ccccc1,383.7298542
Oc1ccc2ccc3cccc4ccc1c2c34,O=C1CCCO1,385.1635019
Oc1ccc2ccccc2c1,C1CCCCC1,310.4625893
Oc1ccc2ccccc2c1,O,328.0
Oc1ccc2ccccc2c1-c1nc(-c2ccccc2)c2ccccn12,C1CCCCC1,361.0
Oc1ccc2ccccc2c1-c1nc(-c2ccccc2)c2ccccn12,CO,343.0
Oc1ccc2ccccc2c1-c1nc(-c2ccccc2)c2ccccn12,ClCCl,362.0
Oc1ccc2ccccc2c1-c1nc(-c2ccccc2)c2ccccn12,O,355.0
Oc1ccc2ccccc2c1-c1nc2c(c3c1-c1ccccc1CC3)-c1ccccc1CC2,ClCCl,346.0
Oc1ccc2ccccc2c1-c1nn(-c2ccccc2)nc1C1=CCCCC1,CO,292.0
Oc1ccc2ccccc2c1/C=N/C1CCCCC1/N=C/c1c(O)ccc2ccccc12,CC#N,397.0
Oc1ccc2ccccc2c1/C=N/CC/N=C/c1c(O)ccc2ccccc12,CC#N,408.0
Oc1ccc2ccccc2c1/C=N/c1cc2ccccc2cc1/N=C/c1c(O)ccc2ccccc12,CC#N,474.0
Oc1ccc2ccccc2c1/C=N/c1cc2nc3ccccc3nc2cc1/N=C/c1c(O)ccc2ccccc12,CC#N,420.0
Oc1ccc2ccccc2c1/C=N/c1ccccc1/N=C/c1c(O)ccc2ccccc12,CC#N,429.0
Oc1ccc2ccccc2c1C1Nc2cccc3cccc(c23)N1,CC#N,334.0
Oc1ccc2ccccc2c1C1Nc2cccc3cccc(c23)N1,CO,333.0
Oc1ccc2ccccc2c1C1Nc2cccc3cccc(c23)N1,CS(C)=O,350.0
Oc1ccc2ccccc2c1C1Nc2cccc3cccc(c23)N1,Cc1ccccc1,337.0
Oc1ccc2ccccc2c1C=NN=Cc1ccc2ccc3cccc4ccc1c2c34,CC#N,416.0
Oc1ccc2ncccc2c1,CC#N,331.0
Oc1ccc2ncccc2c1,CCCC#N,333.0
Oc1ccc2ncccc2c1,CO,331.0
Oc1ccc2ncccc2c1,Cc1ccccc1,332.0
Oc1ccc2ncccc2c1,ClCCl,330.0
Oc1cccc(-c2c3nc(c(-c4cccc(O)c4)c4ccc([nH]4)c(-c4cccc(O)c4)c4nc(c(-c5cccc(O)c5)c5ccc2[nH]5)C=C4)C=C3)c1,CN(C)C=O,647.0
Oc1cccc(/C2=C3\C=CC(=N3)/C(c3cccc(O)c3O)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2cccc(O)c2O)=C2/C=CC(=N2)/C=4c2cccc(O)c2O)c1O,CCO,425.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,C1CCCCC1,322.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,C1CCOC1,327.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,C1COCCO1,325.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CC#N,328.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CC(C)CO,323.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CC(C)O,324.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCCC,318.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCCCC,320.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCCCCCCO,329.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCCCCCO,325.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCCCCO,321.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCCO,331.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCCOC(C)=O,326.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCCO,328.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCO,327.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCOC(C)=O,321.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CCOCC,327.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CN(C)C=O,329.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CO,328.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,CS(C)=O,329.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,Cc1ccccc1,324.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,Cc1ccccc1C,327.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,ClC(Cl)Cl,328.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,ClCCl,325.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,N#Cc1ccccc1,344.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,OCCO,328.0
Oc1cccc(/N=C/c2ccccc2Oc2ccccc2)c1,c1ccccc1,328.0
Oc1cccc(C2=[N+]3C(=C(c4ccccc4)c4cccn4[B-]3(F)F)C=C2)c1,ClC(Cl)Cl,531.0
Oc1cccc(O)c1-c1c2ccc(=[N+]3CCCCC3)cc-2oc2cc(N3CCCCC3)ccc12,CCO,557.0
Oc1cccc(O)c1-c1nc2ccccc2o1,O,334.0
Oc1cccc(O)c1-c1nc2ccccc2s1,O,335.0
Oc1cccc(O)c1O,O,354.0
Oc1cccc2ccccc12,C1CCCCC1,303.4901366
Oc1ccccc1-c1cn2ccccc2n1,C1CCCCC1,337.0
Oc1ccccc1-c1nc(-c2ccccc2)c(-c2ccccc2)[nH]1,CO,316.0
Oc1ccccc1-c1nc(-c2ccccc2)cs1,CC#N,333.0
Oc1ccccc1-c1nc2c(c3c1-c1ccccc1CC3)-c1ccccc1CC2,ClCCl,339.0
Oc1ccccc1-c1nc2c(ccc3c4ccccc4ccc32)[nH]1,CS(C)=O,368.0
Oc1ccccc1-c1nc2c(o1)c(-c1nc3ccccc3s1)cc1ccccc12,CN(C)C=O,330.0
Oc1ccccc1-c1nc2c3ccccc3c3ccccc3c2n1-c1ccccc1,Cc1ccccc1,335.0
Oc1ccccc1-c1nc2c3ccccc3c3ccccc3c2o1,Cc1ccccc1,364.0
Oc1ccccc1-c1nc2c3cccnc3c3ncccc3c2n1-c1ccccc1,Cc1ccccc1,334.0
Oc1ccccc1-c1nc2ncccc2o1,CO,328.0
Oc1ccccc1-c1sc(-c2ccc(Cl)cc2)nc1O,C1COCCO1,365.0
Oc1ccccc1-c1sc(-c2ccccc2)nc1O,C1COCCO1,360.0
Oc1ccccc1-c1sc(-c2ccccn2)nc1O,C1COCCO1,377.0
Oc1ccccc1-c1sc(-c2cccs2)nc1O,C1COCCO1,378.0
Oc1ccccc1/C=N/CC/N=C/c1ccccc1O,CC#N,396.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,C1CCOC1,357.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CC#N,355.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C,363.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CCCCCC,361.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CCCCCCCCC,362.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CCCCCCCCCCCCCCCC,363.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CCCCl,359.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CCN(CC)CC,359.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CCO,356.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CCOCC,358.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,CO,355.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,O=C(O)C(F)(F)F,398.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,OC(C(F)(F)F)C(F)(F)F,345.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,OCC(F)(F)F,350.0
Oc1ccccc1/C=N/N=C/c1ccccc1O,OCCO,357.0
Oc1ccccc1/C=N/c1cc2nc3ccccc3nc2cc1/N=C/c1ccccc1O,CC#N,403.0
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,C1CCOC1,290.0063801
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,C1COCCO1,280.00224
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CC#N,310.00062
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CC(C)=O,298.0004172
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CC(C)O,294.0052333
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CCCCCC,278.0017236
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CCCCO,292.0049057
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CCO,301.0053579
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CCOC(C)=O,289.0006358
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CCOCC,287.0016933
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CN(C)C=O,296.0068674
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CO,312.0027456
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,CS(C)=O,321.0066769
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,Cc1ccccc1,283.0055186
Oc1ccccc1/C=N/c1ccc(Cn2cncn2)cc1,ClCCl,289.0006358
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,C1CCCCC1,353.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,C1CCOC1,355.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,C1COCCO1,367.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CC#N,349.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CC(C)=O,366.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CC(C)CO,352.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CC(C)O,352.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCCC,355.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCCCC,367.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCCCCCCO,355.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCCCCCO,354.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCCCCO,355.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCCO,353.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCCOC(C)=O,367.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCCO,351.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCO,350.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CCOCC,363.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CN(C)C=O,349.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CO,348.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,CS(C)=O,373.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,Cc1ccccc1,381.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,Cc1ccccc1C,359.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,ClC(Cl)Cl,356.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,ClCCl,356.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,N#Cc1ccccc1,357.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,OCCO,349.0
Oc1ccccc1/N=C/c1ccccc1Oc1ccccc1,c1ccccc1,366.0
Oc1ccccc1C1=NC2c3cccc4cccc(c34)C2N1c1ccccc1,Cc1ccccc1,430.0
Oc1ccccc1C1=NCCO1,CCO,250.0
Oc1ccccc1C=NCc1ccccc1OCCCOc1ccccc1CN=Cc1ccccc1O,CN(C)C=O,0.0
Oc1ccccc1C=NN=Cc1ccc2ccc3cccc4ccc1c2c34,CC#N,388.0
Oc1ccccc1CNCc1ccccc1OCCCOc1ccccc1CNCc1ccccc1O,CN(C)C=O,0.0
Oc1nc(-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2)nc(-c2ccc(-c3ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2)n1,CN(C)C=O,448.0
Oc1nc(-c2ccc(-c3ccc(/C=C/c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)s2)nc(-c2ccc(-c3ccc(/C=C/c4ccc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)s2)n1,CN(C)C=O,493.0
Oc1nc(-c2ccccc2)sc1-c1ccccc1,C1COCCO1,362.0
POPOP,C1CCCCC1,358.0
PP,CO,530.0
P[W],CN(C)C=O,1150.0
S=C(NN=Cc1ccccc1OCCCOc1ccccc1C=NNC(=S)Nc1ccc(Br)cc1)Nc1ccc(Br)cc1,ClCCl,312.0
S=C1CCCCC1,CCO,495.0
S=P1(c2ccccc2)C(c2ccccc2)=Cc2cc3ccccc3cc21,ClCCl,387.0
S=P1(c2ccccc2)c2cccc3c4c5ccccc5c5ccccc5c4c4ccc1n4c23,ClCCl,422.0
S=P1(c2ccccc2)c2cccc3ccc4ccc1n4c23,ClCCl,407.0
S=c1[nH]nc(-c2ccc(/C=C/c3ccc(-c4n[nH]c(=S)o4)cc3)cc2)o1,CN(C)C=O,334.0
SBI,ClCCl,900.0
SB[I]I,ClCCl,700.0
Sc1nc(N=Nc2c(-c3ccccc3)[nH]c3ccccc23)n[nH]1,CS(C)=O,411.0
[2H]C([2H])([2H])C(=O)C([2H])([2H])[2H],CC#N,370.0
[2H]C=CC1=C(n2ccc(=O)[nH]c2=O)O[C@H](CO[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C,CO,251.0
[Ar],CO,465.0
[C-]#[N+]/C(=C/c1ccc(N(c2ccc(-c3cccc(N(C)C)c3)cc2)c2ccc(-c3nc4c(-c5cccc(OC)c5)ccc(-c5cccc(OC)c5)c4[nH]3)cc2)cc1)C(=O)O,Cc1ccccc1,428.0
[C-]#[N+]/C(=C/c1ccc(N(c2ccc(-c3cccc(N(C)C)c3)cc2)c2ccc(-c3nc4c(-c5cccc(OC)c5)ccc(-c5cccc(OC)c5)c4[nH]3)cc2)cc1)C(=O)O,ClC(Cl)Cl,428.0
[C-]#[N+]/C(=C/c1ccc(N(c2ccc(-c3cccc(OC)c3)cc2)c2ccc(-c3nc4c(-c5cccc(OC)c5)ccc(-c5cccc(OC)c5)c4[nH]3)cc2)cc1)C(=O)O,Cc1ccccc1,428.0
[C-]#[N+]/C(=C/c1ccc(N(c2ccc(-c3cccc(OC)c3)cc2)c2ccc(-c3nc4c(-c5cccc(OC)c5)ccc(-c5cccc(OC)c5)c4[nH]3)cc2)cc1)C(=O)O,ClC(Cl)Cl,428.0
[C-]#[N+]/C(=C/c1ccc(N(c2ccc(Br)cc2)c2ccc(-c3nc4c(-c5cccc(OC)c5)ccc(-c5cccc(OC)c5)c4[nH]3)cc2)cc1)C(=O)O,Cc1ccccc1,433.0
[C-]#[N+]C(=Cc1ccc(N(c2ccc(-c3cccc(OC)c3)cc2)c2ccc(-c3nc4c(-c5cccc(OC)c5)ccc(-c5cccc(OC)c5)c4[nH]3)cc2)cc1)C(=O)O,Cc1ccccc1,310.0
[C-]#[N+]C(=Cc1ccc(N(c2ccc(Br)cc2)c2ccc(-c3nc4c(-c5cccc(OC)c5)ccc(-c5cccc(OC)c5)c4[nH]3)cc2)cc1)C(=O)O,Cc1ccccc1,365.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,C1CCCCC1,325.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,C1CCOC1,334.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,C1COCCO1,330.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,CC#N,333.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,CC(C)=O,328.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,CCOC(C)=O,330.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,CN(C)C=O,339.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,CO,333.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,CS(C)=O,340.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,Cc1ccccc1,329.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,ClC(Cl)Cl,331.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,ClCCl,336.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,O,315.0
[C-]#[N+]c1ccc(-c2ccc(N(C)C)cc2)cc1,c1ccncc1,340.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,C1CCCCC1,302.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,C1CCOC1,319.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,C1COCCO1,315.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,CC#N,310.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,CCOC(C)=O,315.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,CN(C)C=O,314.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,CO,308.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,CS(C)=O,318.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,Cc1ccccc1,310.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,ClC(Cl)Cl,305.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,ClCCl,307.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,O,298.0
[C-]#[N+]c1ccc(-c2ccc(N)cc2)cc1,c1ccncc1,325.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,C1CCCCC1,316.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,C1CCOC1,331.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,C1COCCO1,326.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,CC#N,324.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,CC(C)=O,325.3333333333333
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,CCCCCC,313.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,CCOC(C)=O,326.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,CN(C)C=O,335.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,CO,327.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,CS(C)=O,338.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,Cc1ccccc1,323.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,ClC(Cl)Cl,322.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,ClCCl,322.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,O,305.0
[C-]#[N+]c1ccc(-c2ccc(NC)cc2)cc1,c1ccncc1,336.0
[C-]#[N+]c1cccc2c(N)cccc12,C1CCOC1,365.0
[C-]#[N+]c1cccc2c(N)cccc12,C1COCCO1,360.0
[C-]#[N+]c1cccc2c(N)cccc12,CC#N,361.0
[C-]#[N+]c1cccc2c(N)cccc12,CC(C)=O,364.0
[C-]#[N+]c1cccc2c(N)cccc12,CC(C)O,361.0
[C-]#[N+]c1cccc2c(N)cccc12,CCCCCC,350.0
[C-]#[N+]c1cccc2c(N)cccc12,CCOC(C)=O,360.0
[C-]#[N+]c1cccc2c(N)cccc12,CN(C)C=O,369.0
[C-]#[N+]c1cccc2c(N)cccc12,CO,365.0
[C-]#[N+]c1cccc2c(N)cccc12,CS(C)=O,372.0
[C-]#[N+]c1cccc2c(N)cccc12,Cc1ccccc1,354.0
[C-]#[N+]c1cccc2c(N)cccc12,ClC(Cl)Cl,358.0
[C-]#[N+]c1cccc2c(N)cccc12,ClCCl,356.0
[C-]#[N+]c1cccc2c(N)cccc12,O,336.0
[C-]#[N+]c1cccc2c(N)cccc12,c1ccncc1,368.0
[Cd+2],CN(C)C=O,457.0
[Cd],Cc1ccccc1,713.0
[Cd][I]I,CS(C)=O,404.0
[Cl-],CCO,634.0
[Cu],ClC(Cl)Cl,485.0
[Cu][I]I,CS(C)=O,526.0
[Fe+3],ClCCl,941.0
[Hf],Cc1ccccc1,687.0
[I],ClC(Cl)Cl,404.0
[N-]=[N+]=NCCOc1ccc(/C=C/c2ccc3n2[B-](F)(F)[n+]2c4n(c5ccccc52)[B-](F)(F)[N+]2=CC=CC2=C34)cc1,ClCCl,694.0
[N-]=[N+]=NCc1ccc2c(c1)c1cccc3cnc2n31,CO,423.0
[NH-]c1cc(N)cc(-c2nc3ccccc3s2)c1,O,343.0
[NH2+]=c1cc2oc3cc(N(CCCS(=O)(=O)O)CCCS(=O)(=O)O)ccc3nc-2c2ccccc12,O,633.0
[NH2+]=c1ccc2c(-c3ccc(C4OCCCO4)cc3)c3c(cc4n3CCCCCC=C4)oc-2c1,O,540.0
[NH2+]=c1ccc2c(-c3ccc(CN4CCCCC4)cc3)c3c(cc4n3CCCCCC=C4)oc-2c1,O,540.0
[NH2+]=c1ccc2c(-c3ccc(F)cc3)c3ccc(N4CCCCC4)cc3oc-2c1,O,535.0
[NH2+]=c1ccc2c(-c3ccc(Oc4ccccc4)cc3)c3c(cc4n3CCCCCC=C4)oc-2c1,O,532.0
[NH2+]=c1ccc2c(-c3ccc4c(c3)OCO4)c3c(cc4n3CCCCCC=C4)oc-2c1,O,535.0
[NH2+]=c1ccc2c(-c3ccc4c(c3)OCO4)c3ccc(O)cc3oc-2c1,O,500.0
[NH2+]=c1ccc2c(-c3ccc4ccccc4c3)c3c(cc4n3CCCCCC=C4)oc-2c1,O,535.0
[NH2+]=c1ccc2c(-c3ccc4ccccc4c3)c3ccc(O)cc3oc-2c1,O,500.0
[NH2+]=c1ccc2c(-c3cccc(CN4CCCCC4)c3)c3c(cc4n3CCCCCC=C4)oc-2c1,O,540.0
[NH2+]=c1ccc2c(-c3cccc(Cl)c3)c3ccc(N4CCCCC4)cc3oc-2c1,O,540.0
[NH2+]=c1ccc2c(-c3cccc(F)c3)c3ccc(N4CCCCC4)cc3oc-2c1,O,540.0
[NH2+]=c1ccc2c(-c3ccccc3)c3ccc(N4CCCCC4)cc3oc-2c1,O,535.0
[NH2-],c1ccccc1,400.4
[NH3+]C(Cc1c[nH]c2ccccc12)C(=O)[O-],O,277.0
[NH3+]C(Cc1ccc(O)cc1)C(=O)[O-],O,274.0
[NH3+]C(Cc1ccccc1)C(=O)[O-],O,258.0
[NH3+]Cc1ccc2c(c1)c1cccc3cnc2n31,CO,424.0
[NH3+]c1cc([NH3+])cc(-c2[nH+]c3ccccc3s2)c1,O,328.0
[NH3+]c1cc([NH3+])cc(-c2nc3ccccc3s2)c1,O,315.0
[NH3+]c1ccc2ccc(O)cc2c1,O,328.0
[N]=[C]/C(=C\c1ccc(OCc2cc(OCc3ccccc3)cc(OCc3ccccc3)c2)cc1)c1ccc(/C2=C3\C=CC(=N3)/C(c3ccc(C(=O)O)cc3)=c3/cc/c4n3[Zn]n3c2ccc3/C(c2ccc(/C([C]=[N])=C/c3ccc(OCc5cc(OCc6ccccc6)cc(OCc6ccccc6)c5)cc3)cc2)=C2/C=CC(=N2)/C=4c2ccc(/C([C]=[N])=C/c3cccc(OCc4cc(OCc5ccccc5)cc(OCc5ccccc5)c4)c3)cc2)cc1,C1CCOC1,600.0
[Ni+2],ClCCl,590.0
[O-][Cl+3]([O-])([O-])[O-],CC(C)=O,602.0
[O-][n+]1c(-c2ccc(Br)cc2)cc(N2CCOCC2)nc1/C=C/c1ccccc1,ClCCl,445.0
[O-][n+]1c(/C=C/C=C/c2ccccc2)nc(N2CCOCC2)c2c1CCCC2,ClCCl,400.0
[O-][n+]1c(/C=C/c2cc3cccc4c5cccc6cccc(c(c2)c34)c65)nc(N2CCOCC2)c2c1CCCC2,ClCCl,470.0
[O-][n+]1c(/C=C/c2ccc(/C=C/c3ccccc3)cc2)nc(N2CCOCC2)c2c1CCCC2,ClCCl,406.0
[O-][n+]1c(/C=C/c2ccc3ccccc3c2)nc(N2CCOCC2)c2c1CCCC2,ClCCl,400.0
[O-][n+]1c(/C=C/c2ccccc2)nc(N2CCOCC2)c2c1CCCC2,ClCCl,400.0
[O-][n+]1c(/C=C/c2ccccc2)nc(Nc2ccccc2)c2c1CCCC2,ClCCl,416.0
[O-][n+]1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)s2)cc1,ClCCl,405.0
[O-][n+]1ccc(-c2ccc(N(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,370.0
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,BrC(Br)Br,758.3819629
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,BrCBr,725.6598985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,BrCCBr,746.5013055
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Brc1cccc(Br)c1,783.3150685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Brc1ccccc1,781.1748634
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Brc1ccccc1Br,760.3989362
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Brc1cccnc1,720.1763224
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C#CCCCC,833.5568513
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C#CCO,513.3034111
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C#Cc1ccccc1,768.5752688
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1=CCCCC1,887.9192547
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1CCCCC1,925.2750809
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1CCNC1,731.2276215
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1CCNCC1,805.3802817
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1CCOC1,764.4652406
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1CCOCC1,789.8066298
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1CCSC1,779.0463215
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1CC[C@H]2CCCC[C@H]2C1,916.3782051
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1COCCN1,697.3414634
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1COCCO1,794.1944444
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C1COCO1,663.3642691
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=C(C)C(=O)OC,754.3799472
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=C(Cl)Cl,772.7297297
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=CC#N,612.2269807
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=CC(=O)OC,736.8814433
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=CCCCC,882.4382716
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=CCO,550.8863198
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=COC(C)=O,752.3947368
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=COCC,789.8066298
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C=Cc1ccccc1,821.5804598
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CBr,760.3989362
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC#N,626.995614
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)C(C)(C)C,733.1025641
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)C(C)C,699.0464548
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)C(Cl)(Cl)Cl,622.8976035
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)C1(C)COCOC1,688.939759
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)CC(C)=O,581.1178862
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)CC(C)C,725.6598985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)N(C)C,666.4568765
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)O,553.0174081
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)OC(C)=O,651.2756264
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)OCC(COC(C)=O)OC(C)=O,707.6980198
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)Oc1cccc(O)c1,537.424812
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(=O)c1ccccc1,704.2118227
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(Br)CBr,731.2276215
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(C)N,783.3150685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(C)O,660.3002309
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(C)c1ccc(O)c(C(C)(C)C)c1,618.8528139
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(C)c1ccc(O)cc1,567.281746
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(C)c1cccc(C(C)(C)C)c1O,683.9952153
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(C)c1cccc(C(C)(C)C)n1,840.9117647
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(C)c1ccccc1O,581.1178862
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)(Cl)Cl,754.3799472
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)=O,677.5118483
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)C(=O)C(C)C,738.7855297
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)C(C)O,625.6236324
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)C(O)C(C)C,712.9925187
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)CC(=O)CC(C)C,752.3947368
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)CCO,583.4897959
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)CO,588.2921811
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)N(C#N)C(C)C,680.7380952
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)O,590.7231405
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)OC(C)C,838.4457478
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(C)c1ccccc1O,567.281746
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(Cl)(Cl)Cl,789.8066298
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(Cl)Cl,725.6598985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(O)C(C)O,551.9498069
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(O)CCO,541.4962121
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(O)CN,570.6786427
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(O)CO,528.4842884
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC(O)c1ccccc1,612.2269807
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC1CCC(C)O1,814.5584046
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC1CCCO1,783.3150685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC1CCCOC1,805.3802817
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC1CCS(=O)(=O)C1,664.9069767
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC1CO1,718.3668342
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC1COC(=O)O1,621.5434783
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC1OCCO1,642.494382
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC#N,655.7568807
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(=O)CC,727.5063613
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(=O)O,566.1584158
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(C)(C)O,697.3414634
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(C)(C)OC,831.1337209
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(C)=O,692.2760291
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(C)C,925.2750809
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(C)CO,595.6458333
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(C)O,607.0276008
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(N)CO,569.5418327
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(O)(C(C)C)C(C)C,754.3799472
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(O)(CC)CC,742.6233766
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(O)CC,625.6236324
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCC(O)CO,543.5551331
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCC#N,672.7294118
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCC(=O)CCC,734.9871465
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCC(C)=O,695.6447689
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCC(C)O,614.8602151
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCC,922.2903226
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCC(=O)CCCC,762.4266667
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCC(C)=O,712.9925187
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCC,922.2903226
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCC,919.3247588
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCC,919.3247588
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCC,922.2903226
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCCC,922.2903226
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCCCCC,919.3247588
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCCCCCO,601.9157895
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCCCCO,600.6512605
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCCCO,599.3920335
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCCO,598.1380753
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCCO,594.4074844
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCCO,589.5051546
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCCO,585.8811475
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCCO,582.3014257
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCN(CCCC)CCCC,890.6853583
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCO,575.2716298
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCOC(=O)c1ccccc1C(=O)OCCCC,723.8227848
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCOC(C)=O,742.6233766
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCOCCCC,866.3939394
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCOCCO,571.82
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCOP(=O)(OCCCC)OCCCC,734.9871465
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCCl,764.4652406
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCO,563.9250493
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCOC(C)=O,762.4266667
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCOCCC,840.9117647
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCCOP(=O)(OCCC)OCCC,705.9506173
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCN(C#N)CC,660.3002309
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCN(CC)C(C)=O,690.6038647
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCN(CC)CC,890.6853583
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCN(CC)P(=O)(N(CC)CC)N(CC)CC,723.8227848
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCN(CC)S(=O)(=O)N(CC)CC,697.3414634
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCN1CCCC1=O,687.2836538
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCNCC,807.6553672
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCO,550.8863198
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC(=O)C(Cl)(Cl)Cl,738.7855297
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC(=O)CC(C)=O,578.7651822
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC(=O)CCl,725.6598985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC(=O)OCC,779.0463215
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC(=O)[C@H](C)O,559.5107632
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC(=O)c1ccccc1,750.4199475
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC(C)=O,750.4199475
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOC=O,699.0464548
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOCC,828.7246377
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOCCO,560.6078431
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOCCOCCOCC,762.4266667
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOCOCC,843.3923304
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOP(=O)(OCC)OCC,685.6354916
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCOc1ccccc1,781.1748634
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCP(C)(=O)N(C)C,675.9101655
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CC[N+](=O)[O-],655.7568807
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCc1ccc(O)cc1,569.5418327
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCc1cccc(O)c1,554.0891473
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CCc1ccccc1O,569.5418327
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C)C#N,652.7625571
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C)C(=N)N(C)C,727.5063613
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C)C(=O)N(C)C,699.0464548
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C)C=O,661.8287037
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C)C=S,649.7954545
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C)P(=O)(N(C)C)N(C)C,699.0464548
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C)c1ccccc1,783.3150685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN(C=O)c1ccccc1,700.7598039
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN1CCCC1=O,677.5118483
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN1CCCC1=S,668.0140187
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN1CCCN(C)C1=O,679.1211401
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CN1CCN(C)C1=O,672.7294118
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CNC(C)=O,549.8269231
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CNC=O,528.4842884
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CNc1ccccc1,672.7294118
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CO,516.0830325
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COC(=O)C(Cl)(Cl)Cl,721.9949495
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COC(=O)OC,748.4554974
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COC(=O)c1ccccc1C(=O)OC,702.4815725
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COC(=O)c1ccccc1O,629.7577093
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COC(C)(C)C,823.9481268
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COC(C)=O,734.9871465
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COC=O,682.3627685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COCC(C)O,588.2921811
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COCCC#N,643.9414414
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COCCO,549.8269231
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COCCOC,748.4554974
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COCCOCCOC,740.6994819
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COCCOCCOCCOC,734.9871465
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COCOC,798.6312849
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COP(=O)(OC)OC,655.7568807
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COc1cc(O)cc(OC)c1,562.8149606
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COc1ccc(O)cc1,629.7577093
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COc1cccc(OC)c1O,683.9952153
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COc1ccccc1,770.6469003
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,COc1ccccc1OC,744.5572917
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CS(C)=O,633.9467849
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CSCS(C)=O,649.7954545
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,CSc1ccccc1,772.7297297
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C[N+](=O)[O-],617.5161987
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,C[Si](C)(C)C,931.3029316
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cc(Br)ccc1Br,783.3150685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1,682.3627685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cc(C)c(C)c(O)c1,624.2576419
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cc(C)cc(C)c1,869.0273556
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cc(C)cc(O)c1,601.9157895
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cc(C)nc(C)c1,785.467033
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cc(O)ccc1Cl,560.6078431
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(C(C)C)c(O)c1,590.7231405
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(C(C)C)cc1O,587.0841889
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(C)c(C)c1C,866.3939394
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(C)c(O)c1C,666.4568765
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(C)cc1,863.776435
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(O)c(C(C)(C)C)c1,610.9188034
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(O)c(C)c1,568.4095427
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(O)cc1,536.4165103
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccc(O)cc1C,605.7415254
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cccc(C)n1,774.8238482
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cccc(O)c1,545.629771
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cccc(O)c1C,633.9467849
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1cccc2ccccc12,809.9433428
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccccc1,843.3923304
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccccc1O,550.8863198
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccccn1,746.5013055
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccncc1,723.8227848
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cc1ccncc1C,734.9871465
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cl/C=C/Cl,835.994152
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Cl/C=C\Cl,682.3627685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)(Cl)Br,821.5804598
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)(Cl)Cl,882.4382716
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)=C(Cl)C(Cl)(Cl)Cl,871.6768293
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)=C(Cl)C(Cl)=C(Cl)Cl,887.9192547
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)=C(Cl)Cl,890.6853583
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)C(Cl)(Cl)Cl,785.467033
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)C(Cl)Cl,725.6598985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC(Cl)Cl,731.2276215
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC1=C(Cl)C(Cl)(Cl)C(Cl)=C1Cl,871.6768293
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC1CCCCC1,789.8066298
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClC=C(Cl)Cl,796.4066852
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCC(Cl)CCl,707.6980198
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCC(Cl)Cl,709.4540943
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCC1CO1,642.494382
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCCCCCCCCCCCl,781.1748634
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCCCCCl,723.8227848
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCCCCl,711.2189055
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCCCl,692.2760291
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCCOCCCl,687.2836538
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ClCCl,702.4815725
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Clc1ccc(Cl)c(Cl)c1,789.8066298
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Clc1cccc(Cl)c1,779.0463215
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Clc1cccc2ccccc12,772.7297297
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Clc1ccccc1,776.9293478
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Clc1ccccc1Cl,752.3947368
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Clc1ccccn1,682.3627685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,FC(Cl)(Cl)Cl,858.5885886
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,FC(F)(Cl)C(F)(Cl)Cl,861.1746988
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,FC(F)(F)C(Cl)(Cl)Cl,845.887574
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,FC(F)(F)C(F)(Cl)C(F)(F)Cl,850.922619
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,FC(F)(F)CCCl,702.4815725
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,FC(F)(F)c1ccccc1,742.6233766
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,FC1(F)C(F)(F)C(F)(Cl)C1(F)Cl,858.5885886
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1c(F)c(F)c(F)c(F)c1F,835.994152
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1cc(F)c(F)c(F)c1F,744.5572917
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1cc(F)cc(F)c1,861.1746988
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1ccc(F)cc1,785.467033
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1cccc(F)c1,766.5147453
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1cccc(F)n1,660.3002309
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1ccccc1,772.7297297
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1ccccc1F,727.5063613
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1ccccn1,674.3160377
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Fc1nc(F)c(F)c(F)c1F,787.630854
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,ICI,783.3150685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Ic1cccc2ccccc12,774.8238482
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Ic1ccccc1,789.8066298
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#CC(Cl)(Cl)Cl,714.775
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#CCCO,479.7147651
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#CCc1ccccc1,669.5784543
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#CN1CCCC1,671.1502347
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#CN1CCCCC1,679.1211401
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#CN1CCOCC1,668.0140187
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#Cc1ccc(O)cc1,547.7203065
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#Cc1ccccc1,688.939759
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,N#Cc1ccccn1,646.8552036
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,NC=O,512.3835125
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,NCCN,680.7380952
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,NCCO,551.9498069
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Nc1cccc(O)c1,607.0276008
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Nc1ccccc1,645.3950339
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Nc1ccccc1O,605.7415254
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O,453.0
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=C(Oc1ccccc1)c1ccccc1O,682.3627685
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=C1CCCC1,725.6598985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=C1CCCCC1,718.3668342
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=C1CCCCCN1CO,687.2836538
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=C1CCCO1,645.3950339
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=C1NCCC1C1CCCCC1,707.6980198
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=C1OCCO1,588.2921811
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=CO,526.5377532
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=S1(=O)CCCC1,649.7954545
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=[N+]([O-])C1CCCCC1,721.9949495
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=[N+]([O-])c1ccccc1,693.9563107
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,O=[N+]([O-])c1ccccc1O,643.9414414
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OC(C(F)(F)F)C(F)(F)F,437.8407351
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OC1CCCC1,608.3191489
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OC1CCCCC1,605.7415254
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCC(Cl)(Cl)Cl,528.4842884
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCC(F)(F)C(F)F,481.3299663
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCC(F)(F)F,478.1103679
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCC(O)CO,501.5964912
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCC1CCCO1,568.4095427
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCCCCO,550.8863198
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCCCO,534.411215
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCCO,520.7832423
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCCc1ccccc1,589.5051546
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCCl,518.892922
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCN(CCO)CCO,516.0830325
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCO,507.8330373
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCOCCO,531.4312268
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCOCCOCCO,541.4962121
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCOCCOCCOCCO,547.7203065
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCS,533.4141791
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCSCCO,524.6055046
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCCc1ccccc1,577.5959596
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCc1ccccc1,567.281746
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,OCc1ccco1,568.4095427
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Oc1c(Cl)cccc1Cl,617.5161987
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Oc1ccc(Br)cc1,547.7203065
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Oc1ccc(Cl)cc1,525.5698529
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Oc1ccc(F)cc1,515.1531532
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Oc1ccccc1,535.411985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,Oc1ccccc1Cl,522.6873857
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,S=C=S,871.6768293
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,[2H]C(Cl)(Cl)Cl,733.1025641
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccc(C2CCCCC2)cc1,835.994152
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccc(COCc2ccccc2)cc1,787.630854
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccc(Oc2ccccc2)cc1,809.9433428
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccc2c(c1)CCCC2,853.4626866
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccc2ncccc2c1,725.6598985
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccccc1,833.5568513
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccncc1,705.9506173
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccoc1,794.1944444
[O-]c1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1,c1ccsc1,807.6553672
[O-]c1c(-c2nc3ccccc3s2)cc2ccc3cccc4ccc1c2c34,CC#N,514.0
[O-]c1c(-c2nc3ccccc3s2)cc2ccc3cccc4ccc1c2c34,CS(C)=O,524.0
[O-]c1ccc2ccccc2c1,O,346.0
[O-]c1ccccc1-c1[nH+]c2c3ccccc3c3ccccc3c2n1-c1ccccc1,Cc1ccccc1,365.0
[O-]c1ccccc1/C=N/c1ccccc1/N=C/c1ccccc1[O-],C1CCOC1,380.0
[O-]c1ccccc1C=Nc1cccc2ccc(-c3nc4ccccc4[nH]3)nc12,Cc1ccccc1,318.0
[OH-],CCO,515.0
[Pb+2],Cc1ccccc1,717.0
[Pr],CCO,210.0
[Sn+2],CS(C)=O,691.0
[Zn+2],CN(C)C=O,673.0
[Zn],C1CCOC1,371.0
[Zr],CS(C)=O,687.0
c12c3c4c5c1c1c6c7c2c2c8c3c3c9c4c4c%10c5c5c1c1c6c6c%11c%12c%13c%14c%15c%16c%17c%14c%14c%18c%13c%11c1c1c5c%10c5c(c%14c%10c%17c%11c%13c%16c%14c%16c%15c%12c%12c%16c(c2c7c%126)c2c8c3c(c%13c%142)c2c9c4c5c%10c%112)c%181,CC1CCCCC1,470.0
c1cc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)cc(-n2c3ccccc3c3ccccc32)c1,ClCCl,376.0
c1cc(-c2cc3ccc4cc(-c5ccncc5)cc5ccc(c2)c3c45)ccn1,Cc1ccccc1,340.0
c1cc(-c2ccc(N3CCCCC3)cc2)n2ncnc2n1,ClCCl,387.0
c1cc(-c2ccc3c(c2)CCCO3)ccc1-c1ccc2c(c1)CCCO2,C1CCCCC1,295.0
c1cc(-c2ccc3ccc4c(-c5ccncc5)ccc5ccc2c3c54)ccn1,Cc1ccccc1,358.0
c1cc(-c2ccc3sc4ccccc4c3c2)cc(-c2cc(-c3cccc(-c4ccc5sc6ccccc6c5c4)c3)ncn2)c1,ClCCl,336.0
c1cc(-c2cnc3c(ccc4cc(-c5ccsc5)cnc43)c2)cs1,ClCCl,433.0
c1cc(-c2nc3sc(-c4cc[nH+]cc4)nc3s2)cc[nH+]1,O,368.0
c1cc(-c2nc3sc(-c4ccncc4)nc3s2)ccn1,O,357.0
c1cc(CN[C@@H]2CCCC[C@H]2NCc2ccsc2)cs1,CCO,300.0
c1cc(N2CCCC2)ccn1,CC#N,285.0
c1cc(N2CCCC2)ccn1,CC1CCCCC1,293.0
c1cc(N2CCCC2)ccn1,CCCCCCC,293.0
c1cc(N2CCCC2)ccn1,CCO,286.0
c1cc(N2CCCC2)ccn1,CN(C)C=O,284.0
c1cc(N2CCCC2)ccn1,ClC(Cl)Cl,285.0
c1cc(N2CCCC2)ccn1,O,280.0
c1cc2c([nH]c3c4[nH]c5sccc5c4c4nsnc4c23)s1,C1CCOC1,420.0
c1cc2c([nH]c3c4[nH]c5sccc5c4c4nsnc4c23)s1,CCOC(C)=O,414.0
c1cc2c([nH]c3c4[nH]c5sccc5c4c4nsnc4c23)s1,CN(C)C=O,423.0
c1cc2c([nH]c3c4[nH]c5sccc5c4c4nsnc4c23)s1,Cc1ccccc1,411.0
c1cc2c([nH]c3c4[nH]c5sccc5c4c4nsnc4c23)s1,ClCCl,415.0
c1cc2c3c(c1)-c1ccc4c5c(ccc(c15)B3c1ccc3c5c(ccc-2c15)CC3)CC4,Cc1ccccc1,495.0
c1cc2c3c(c1)-c1ccc4ccccc4c1NB3Nc1c-2ccc2ccccc12,ClCCl,381.0
c1cc2c3c(c1)-c1cccc4ccn(c14)B3n1ccc3cccc-2c31,C1CCOC1,385.0
c1cc2c3c(c1)-c1cccc4ccn(c14)B3n1ccc3cccc-2c31,ClCCl,349.0
c1cc2c3c(ccc(N4CCOCC4)c3c1)-c1nc3c4cccnc4c4ncccc4c3nc1-2,O=C(O)C(F)(F)F,364.0
c1cc2c3c(cccc3c1)-c1c-2c2c3ccccc3c3ccc4c5c6c(c7c8ccccc8c8ccc9c%10c%11c(c%12c%13ccccc%13c%13ccc%14c1c1c2c3c4c2c1c1c%14c%13c%12c%10c1c1c9c8c7c5c21)-c1cccc2cccc-%11c12)-c1cccc2cccc-6c12,C1CCOC1,475.0
c1cc2c3c(cccc3c1)-c1c-2c2ccccc2c2ccccc12,CCCCCCC,397.0
c1cc2c3c(cccc3c1)-c1c-2ccc2c1ccc1ccccc12,CCCCCCC,405.0
c1cc2c3c(cccc3c1)-c1cc3c(ccc4ccccc43)cc1-2,CCCCCCC,405.0
c1cc2c3c(cccc3c1)C(N1CCOCCNCCOCCOCC1)=N2,CC#N,427.0
c1cc2c3c(cccc3c1)C(N1CCOCCOCCN(C3=Nc4cccc5cccc3c45)CCOCC1)=N2,CC#N,427.0
c1cc2c3c(cccc3c1)C(N1CCOCCOCCOCCOCC1)=N2,CC#N,427.0
c1cc2c3c(cccc3c1)CC2,C1CCCCC1,292.0
c1cc2c3c4c5c(cccc5cc3c1)-c1cccn1B4n1cccc1-2,C1CCOC1,505.0
c1cc2c3c4c5c(cccc5cc3c1)-c1cccn1B4n1cccc1-2,ClCCl,505.0
c1cc2c3cc1c1ccc4c(c1)c1cc(ccc1[C@]15OCCO[C@]41OCCO5)c1ccc4c(c1)c1cc(ccc1[C@]15OCCO[C@]41OCCO5)c1ccc(c3c1)[C@]13OCCO[C@]21OCCO3,Cc1ccccc1,300.0
c1cc2c3ccc[n+]4cccc(c5ccc[n+](c1)c25)c34,CC#N,422.0
c1cc2c3ccc[n+]4cccc(c5ccc[n+](c1)c25)c34,CS(C)=O,432.0
c1cc2c3ccc[n+]4cccc(c5ccc[n+](c1)c25)c34,C[N+](=O)[O-],424.0
c1cc2c3ccc[n+]4cccc(c5ccc[n+](c1)c25)c34,O,422.0
c1cc2c3cscc3c3ccsc3c2s1,ClC(Cl)Cl,360.0
c1cc2cc(-c3ccncc3)c3cccc4c(-c5ccncc5)cc(c1)c2c34,Cc1ccccc1,344.0
c1cc2cc(-c3ccncc3)c3cccc4cc(-c5ccncc5)c(c1)c2c43,Cc1ccccc1,346.0
c1cc2cc(c1)c1ccc3c(c1)c1cc(ccc1[C@]14OCCO[C@]31OCCO4)c1ccc3c(c1)c1cc(ccc1[C@]14OCCO[C@]31OCCO4)c1cccc2c1,ClC(Cl)Cl,260.0
c1cc2cc(c1)c1ccc3ccc4ccc(cc4c3c1)c1ccc3ccc4ccc(cc4c3c1)c1cccc2c1,Cc1ccccc1,355.0
c1cc2cc(c1)c1cccc(c1)c1ccc3c(c1)c1cc(ccc1[C@]14OCCO[C@]31OCCO4)c1cccc(c1)c1cccc2c1,ClC(Cl)Cl,255.0
c1cc2cc(c1)c1cccc(c1)c1ccc3ccc4ccc(cc4c3c1)c1cccc(c1)c1cccc2c1,Cc1ccccc1,343.0
c1cc2cc(c1)c1cccc(c1)c1cccc(c1)c1cccc(c1)c1cccc(c1)c1cccc2c1,ClC(Cl)Cl,251.0
c1cc2ccc1-c1ccc(cc1)-c1ccc([se]1)-c1ccc(cc1)-c1ccc(cc1)-c1ccc([se]1)-c1ccc(cc1)-c1ccc(cc1)-c1ccc-2[se]1,C1CCOC1,365.0
c1cc2ccc1-c1ccc(cc1)-c1ccc(s1)-c1ccc(cc1)-c1ccc(cc1)-c1ccc(s1)-c1ccc(cc1)-c1ccc(cc1)-c1ccc(s1)-c1ccc(cc1)-c1ccc(cc1)-c1ccc-2s1,C1CCOC1,354.0
c1cc2ccc1-c1ccc(cc1)-c1ccc(s1)-c1ccc(cc1)-c1ccc(cc1)-c1ccc(s1)-c1ccc(cc1)-c1ccc(cc1)-c1ccc-2s1,C1CCOC1,346.0
c1cc2ccc3[nH]c4ccc5cccc6c(c1)c2c3c4c56,ClC(Cl)Cl,425.0
c1cc2ccc3[o+]c4ccc5cccc6c7cccc8c(c1)c2c3c(c87)c4c56,ClCCl,573.0
c1cc2ccc3[s+]c4ccc5cccc6c7cccc8c(c1)c2c3c(c87)c4c56,ClCCl,600.0
c1cc2ccc3cc4[nH]c(-c5cc6c(cc7ccc8cccc9ccc6c7c89)[nH]5)cc4c4ccc(c1)c2c34,C1CCOC1,473.0
c1cc2ccc3cc4[nH]ccc4c4ccc(c1)c2c34,CCOC(C)=O,384.0
c1cc2ccc3cc4cccc5ccc6cc(c1)c2c3c6c54,ClCCl,433.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,C1COCCO1,336.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CC#N,334.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CC(=O)N(C)C,337.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CCCCCCCCCCO,336.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CCCCCCCCO,335.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CCCCCCO,335.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CCCCO,335.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CCO,333.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,CS(C)=O,338.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,Cc1ccccc1,337.0
c1cc2ccc3ccc(-c4ccc(-c5nnc(-c6ccc(-c7nnc(-c8ccc(-c9ccc%10ccc%11cccc%12ccc9c%10c%11%12)s8)o7)cc6)o5)s4)c4ccc(c1)c2c34,ClC(Cl)Cl,338.0
c1cc2ccc3ccc(-c4ccncc4)c4ccc(c1)c2c34,Cc1ccccc1,344.0
c1cc2ccc3ccc(-n4c5ccccc5c5ccccc54)c4ccc(c1)c2c34,CCCCCC,344.0
c1cc2ccc3ccc(-n4c5ccccc5c5ccccc54)c4ccc(c1)c2c34,CCO,344.0
c1cc2ccc3ccc(-n4c5ccccc5c5ccccc54)c4ccc(c1)c2c34,CCOC(C)=O,344.0
c1cc2ccc3ccc(-n4c5ccccc5c5ccccc54)c4ccc(c1)c2c34,ClCCl,347.0
c1cc2ccc3ccc(OP4(Oc5ccc6ccc7cccc8ccc5c6c78)=NP(Oc5ccc6ccc7cccc8ccc5c6c78)(Oc5ccc6ccc7cccc8ccc5c6c78)=NP(Oc5ccc6ccc7cccc8ccc5c6c78)(Oc5ccc6ccc7cccc8ccc5c6c78)=N4)c4ccc(c1)c2c34,ClCCl,343.0
c1cc2ccc3ccc4cc3c2cc1c1ccc2c(c1)c1cc(ccc1[C@]13OCCO[C@]21OCCO3)c1ccc2c(c1)c1cc4ccc1[C@]13OCCO[C@]21OCCO3,Cc1ccccc1,353.0
c1cc2ccc3cccc4c(-c5cc(-c6nccs6)nc(-c6nccs6)c5)cc(c1)c2c34,CC#N,367.0
c1cc2ccc3cccc4c(-c5cc(-c6nccs6)nc(-c6nccs6)c5)cc(c1)c2c34,CCCCCC,344.0
c1cc2ccc3cccc4c(-c5cc(-c6nccs6)nc(-c6nccs6)c5)cc(c1)c2c34,CO,365.0
c1cc2ccc3cccc4c(-c5cc(-c6nccs6)nc(-c6nccs6)c5)cc(c1)c2c34,ClC(Cl)Cl,351.0
c1cc2ccc3cccc4ccc(c1)c2c34,C1CCCCC1,334.0
c1cc2ccc3cccc4ccc(c1)c2c34,C1CCOC1,373.0
c1cc2ccc3cccc4ccc(c1)c2c34,CC#N,335.0
c1cc2ccc3cccc4ccc(c1)c2c34,CCCCCC,330.0
c1cc2ccc3cccc4ccc(c1)c2c34,CCO,334.0
c1cc2ccc3cccc4ccc(c1)c2c34,CCOC(C)=O,335.0
c1cc2ccc3cccc4ccc(c1)c2c34,CO,330.0
c1cc2ccc3cccc4ccc(c1)c2c34,Cc1ccccc1,362.0
c1cc2ccc3cccc4ccc(c1)c2c34,ClC(Cl)Cl,337.0
c1cc2ccc3cccc4ccc(c1)c2c34,ClCCl,333.0
c1cc2ccc3sc4ccc5cccc6c(c1)c2c3c4c56,ClC(Cl)Cl,412.0
c1cc2cnc3c4occc4c(c1)n23,CO,413.0
c1cc2cnc3c4sccc4c(c1)n23,CO,420.0
c1cc2oc3cccc4oc5cccc6oc(c1)c2[c+](c34)c65,CC#N,481.0
c1cc2sc3ccsc3c2s1,ClCCl,291.0
c1cc2sccc2s1,ClCCl,270.0
c1cc[nH]c1,CC(C)=O,458.5
c1cc[pH]c1,C1CCOC1,412.0
c1ccc(-[n+]2c3ccc4cccc5c6cccc7c8cccc9ccc2c(c98)c(c67)c3c45)cc1,ClCCl,512.0
c1ccc(-[n+]2nc3ccccc3c3ccccc32)cc1,ClCCl,383.0
c1ccc(-c2[nH]c3ccccc3c2N=Nc2nc3ccccc3s2)cc1,ClC(Cl)Cl,533.0
c1ccc(-c2[nH]c3ccccc3c2N=Nc2nncs2)cc1,CS(C)=O,496.0
c1ccc(-c2[o+]c3c(-c4ccccc4)c(-c4ccccc4)c4cc5cccc6ccc7cc(c2-c2ccccc2)c3c4c7c65)cc1,ClCCl,612.0
c1ccc(-c2[o+]c3c(-c4ccccc4)c(-c4ccccc4)c4cccc5c6ccccc6c(c2-c2ccccc2)c3c45)cc1,ClCCl,514.0
c1ccc(-c2[o+]c3c(-c4ccccc4)c(-c4ccccc4)c4cccc5ccc(c2-c2ccccc2)c3c54)cc1,ClCCl,491.0
c1ccc(-c2c(-c3ccccc3)[n+]3c4ccccc4c(-c4ccccc4)c(-c4ccccc4)c3c3ccccc23)cc1,ClCCl,454.0
c1ccc(-c2c(-c3ccccc3)c3c4ccsc4c(-c4ccccc4)c(-c4ccccc4)[n+]3c3ccccc23)cc1,ClCCl,436.0
c1ccc(-c2c(-c3ccccc3)c3cccc4c(-c5ccccc5)c(-c5ccccc5)c5cccc2c5[n+]34)cc1,ClCCl,355.0
c1ccc(-c2c3c(c(-c4ccccc4)c4c2-c2ccccc2C4)-c2ccccc2C3)cc1,C1CCCCC1,329.0
c1ccc(-c2c3c(c(-c4ccccc4)c4cc5ccccc5cc24)Cc2c(c(-c4ccccc4)c4cc5ccccc5cc4c2-c2ccccc2)C3)cc1,CC#N,389.0
c1ccc(-c2c3c(c(-c4ccccc4)c4cc5ccccc5cc24)Cc2c(c(-c4ccccc4)c4cc5ccccc5cc4c2-c2ccccc2)C3)cc1,CCCCCC,388.0
c1ccc(-c2c3c(c(-c4ccccc4)c4cc5ccccc5cc24)Cc2c(c(-c4ccccc4)c4cc5ccccc5cc4c2-c2ccccc2)C3)cc1,CO,388.0
c1ccc(-c2c3c(c(-c4ccccc4)c4cc5ccccc5cc24)Cc2c(c(-c4ccccc4)c4cc5ccccc5cc4c2-c2ccccc2)C3)cc1,Cc1ccccc1,391.0
c1ccc(-c2c3c(c(-c4ccccc4)c4cc5ccccc5cc24)Cc2c(c(-c4ccccc4)c4cc5ccccc5cc4c2-c2ccccc2)C3)cc1,ClCCl,392.0
c1ccc(-c2c3ccc(=[N+]4CCCCC4)cc-3oc3cc(N4CCCCC4)ccc23)cc1,CCO,564.0
c1ccc(-c2c3ccc(=[N+]4CCCCC4)cc-3oc3cc(N4CCCCC4)ccc23)cc1,ClCCl,565.0
c1ccc(-c2c3ccccc3c(-c3ccc4ccccc4c3)c3ccccc23)nc1,ClCCl,375.0
c1ccc(-c2c3ccccc3c(-c3ccc4oc5ccc(-c6c7ccccc7c(-c7ccccc7)c7ccccc67)cc5c4c3)c3ccccc23)cc1,ClCCl,375.0
c1ccc(-c2c3ccccc3c(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c3)c3ccccc23)cc1,ClCCl,437.0
c1ccc(-c2c3ccccc3c(-c3cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)n3)c3ccccc23)cc1,ClCCl,433.0
c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc4ccccc4cc23)cc1,ClCCl,493.0
c1ccc(-c2c3ccccc3c(-c3cncnc3)c3ccccc23)cc1,CCO,394.0
c1ccc(-c2c3ccccc3c(-c3cncnc3)c3ccccc23)cc1,ClCCl,397.0
c1ccc(-c2c3ccccc3c(-c3ncccn3)c3ccccc23)cc1,CCO,390.0
c1ccc(-c2c3ccccc3c(-c3ncccn3)c3ccccc23)cc1,ClCCl,393.0
c1ccc(-c2c3ccccc3cc3ccccc23)cc1,C1CCOC1,386.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,C1CCOC1,371.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,CC#N,380.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,CC(C)=O,381.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,CCO,326.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,CCOC(C)=O,360.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,CN(C)C=O,337.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,CO,321.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,CS(C)=O,338.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,ClC(Cl)Cl,408.0
c1ccc(-c2cc(-c3ccc(-c4nc(-c5ccccn5)c(-c5ccccn5)[nH]4)cc3)cc(-c3ccccn3)n2)nc1,ClCCl,388.0
c1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1,CC#N,357.0
c1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1,CCCCCC,354.0
c1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1,CCO,362.0
c1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1,CO,359.0
c1ccc(-c2cc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1,ClCCl,360.0
c1ccc(-c2cc(-c3ccc(N4c5ccccc5C(c5ccccc5)(c5ccccc5)c5ccccc54)cc3)nc(-c3ccccc3)n2)cc1,Cc1ccccc1,368.8811189
c1ccc(-c2cc(-c3ccc(N4c5ccccc5C(c5ccccc5)(c5ccccc5)c5ccccc54)cn3)nc(-c3ccccc3)n2)cc1,Cc1ccccc1,378.8461538
c1ccc(-c2cc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3cc(-c5cc(-c6ccccn6)nc(-c6ccccn6)c5)ccc3-4)cc(-c3ccccn3)n2)nc1,ClC(Cl)Cl,344.0
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,C1CCOC1,343.997248
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,CC#N,342.9943406
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,CCC#N,342.9943406
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,CCCC#N,343.997248
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,CCCCCC,341.997264
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,CCCO,342.9943406
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,CCO,342.9943406
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,CO,342.9943406
c1ccc(-c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccn2)nc1,Cc1ccccc1,342.9943406
c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4c(c3)C3(c5cc(-c6cc(-c7ccccc7)cc(-c7ccccc7)c6)ccc5-4)c4ccccc4-c4c3c3c5ccccc5ccc3c3ccccc43)c2)cc1,C1CCOC1,379.0
c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4-c4c3c3c5ccccc5c(-c5cc(-c6ccccc6)cc(-c6ccccc6)c5)cc3c3ccccc43)c2)cc1,C1CCOC1,387.0
c1ccc(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)cc1,C1COCCO1,250.0
c1ccc(-c2cc3c(-c4ccccc4)c4cccc5c(-c6ccccc6)cc6c(-c7ccccc7)c7cccc2c7c3c6c54)cc1,ClCCl,454.0
c1ccc(-c2cc3c(oc4ccccc43)c(-c3ccccc3)[o+]2)cc1,CC#N,385.0
c1ccc(-c2cc3c(oc4ccccc43)c(-c3ccccc3)[o+]2)cc1,ClCCCl,395.0
c1ccc(-c2cc3cc(-c4nnc(-c5ccccc5)o4)ccn3n2)cc1,C1CCCCC1,342.0
c1ccc(-c2cc3cc4cc(-c5ccccc5)oc4cc3o2)cc1,ClCCl,357.0
c1ccc(-c2cc3cc4cc5oc(-c6ccccc6)cc5cc4cc3o2)cc1,ClCCl,408.0
c1ccc(-c2cc3cc4cccc5c(-c6ccccc6)cc6cc7cccc2c7c3c6c45)cc1,ClCCl,439.0
c1ccc(-c2cc3cc4oc(-c5ccccc5)cc4cc3o2)cc1,ClCCl,370.0
c1ccc(-c2cc3ccc4c(ccc5cc(-c6ccccc6)oc54)c3o2)cc1,ClCCl,377.0
c1ccc(-c2cc3ccc4cc(-c5ccccn5)cc5ccc(c2)c3c45)nc1,Cc1ccccc1,342.0
c1ccc(-c2cc3ccc4cc5c(ccc6cc(-c7ccccc7)oc65)cc4c3o2)cc1,ClCCl,422.0
c1ccc(-c2cc3ccc4cccc5ccc(c2)c3c45)nc1,Cc1ccccc1,338.0
c1ccc(-c2cc3cccc4cc(-c5ccccc5)c5cc(-c6cc7[b-]8c(c6)c(-c6ccccc6)cc6cccc(cc7-c7ccccc7)[n+]86)cc2[b-]5[n+]34)cc1,C1CCCCC1,444.0
c1ccc(-c2cc3cccc[n+]3[b-]3c(-c4cccc5[b-]4[n+]4ccccc4cc5-c4ccccc4)cccc32)cc1,C1CCCCC1,449.0
c1ccc(-c2cc3ncc4cccc2n43)cc1,CO,450.0
c1ccc(-c2ccc(-[n+]3nc4c(-c5ccccc5)cc(-c5ccccc5)cc4c4ccccc43)cc2)cc1,ClCCl,449.0
c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccc(-c5ccccc5)cc4)c3)cc2)cc1,C1COCCO1,288.0
c1ccc(-c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,ClCCl,291.0
c1ccc(-c2ccc(-c3ccc(-c4cc(-c5ccc(-c6ccc(-c7ccccc7)cc6)cc5)cc(-c5ccc(-c6ccc(-c7ccccc7)cc6)cc5)c4)cc3)cc2)cc1,C1COCCO1,306.5
c1ccc(-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)cc1,C1CCOC1,299.0
c1ccc(-c2ccc(-c3ccc(-c4ccccc4)cc3)cc2)cc1,C1COCCO1,310.0
c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3nsnc23)cc1,C1CCOC1,394.0
c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3nsnc23)cc1,CC(C)=O,382.0
c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3nsnc23)cc1,CCCCCC,394.0
c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3nsnc23)cc1,CCOCC,392.0
c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1,C1CCOC1,437.0
c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1,CC(C)=O,424.0
c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1,CCCCCC,438.0
c1ccc(-c2ccc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)c3nsnc23)cc1,CCOCC,435.0
c1ccc(-c2ccc(-c3ccc4c(c3)CCCO4)cc2)cc1,C1CCCCC1,289.0
c1ccc(-c2ccc(-c3ccc4c(c3)CCO4)cc2)cc1,C1CCCCC1,289.0
c1ccc(-c2ccc(-c3ccccc3)cc2)cc1,C1CCOC1,281.0
c1ccc(-c2ccc(-c3ccccc3)cc2)cc1,C1COCCO1,276.0
c1ccc(-c2ccc(-c3ccccc3)cc2)cc1,CCO,280.0
c1ccc(-c2ccc(-c3nc(-c4ccccc4)c(N(c4ccccc4)c4ccccc4)[se]3)cc2)cc1,ClC(Cl)Cl,394.0
c1ccc(-c2ccc(-c3nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)n3)cc2)cc1,Cc1ccccc1,403.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,C1CCOC1,329.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,CC#N,341.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,CCCCO,339.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,CCO,338.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,CN(C)C=O,338.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,CO,336.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,Cc1ccccc1,332.0
c1ccc(-c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(-c4ccccc4)ccc2N3)cc1,ClCCl,332.0
c1ccc(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1,C1CCCCC1,319.0
c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc3c(c2)c2cc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)ccc2n3-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)cc1,Cc1ccccc1,362.0
c1ccc(-c2ccc3c(c2)c2cccc4cnc3n42)cc1,CO,430.0
c1ccc(-c2ccc3c(c2)c2ccccc2n2c4ccccc4nc32)cc1,CC#N,338.0
c1ccc(-c2ccc3c4ccc(-c5ccccc5)c5c(-c6ccccc6)ccc(c6ccc(-c7ccccc7)c2c36)c54)cc1,ClCCl,486.0
c1ccc(-c2ccc3c4ccc(-c5ccccc5)c5c(-c6ccccc6)ccc(c6cccc2c63)c54)cc1,ClCCl,473.0
c1ccc(-c2ccc3nc(Nc4ccc5cc(-c6ccccc6)ccc5n4)ccc3c2)cc1,ClCCl,453.0
c1ccc(-c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1,C1CCCCC1,308.0
c1ccc(-c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)nc1,C1CCCCC1,308.0
c1ccc(-c2cccc3ncc(-c4ccccc4)n23)cc1,ClCCl,337.0
c1ccc(-c2ccccc2)cc1,C1COCCO1,246.0
c1ccc(-c2ccccc2-[n+]2nc3ccccc3c3ccccc32)cc1,ClCCl,425.0
c1ccc(-c2ccnc(-c3ccccc3)n2)cc1,ClC(Cl)Cl,278.0
c1ccc(-c2ccnc3c2ccc2c(-c4ccccc4)ccnc23)cc1,ClCCl,279.0
c1ccc(-c2ccnc3ncnn23)cc1,ClCCl,310.0
c1ccc(-c2cn3ccccc3n2)cc1,C1CCCCC1,336.0
c1ccc(-c2cnc(-c3ccccc3)o2)cc1,C1CCCCC1,313.0
c1ccc(-c2cnc(-c3ccccc3)o2)cc1,CCOC(C)=O,493.0
c1ccc(-c2cnn(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n2)cc1,C1CCOC1,348.0
c1ccc(-c2cnn(-c3cccc4ccccc34)n2)cc1,CO,260.0
c1ccc(-c2cnn(-c3ccccn3)n2)cc1,CO,276.0
c1ccc(-c2csc(-c3ccncc3)n2)cc1,CC#N,370.0
c1ccc(-c2csc(-c3ccncc3)n2)cc1,CCO,325.0
c1ccc(-c2csc(-c3ccncc3)n2)cc1,CN(C)C=O,323.0
c1ccc(-c2csc(-c3ccncc3)n2)cc1,CS(C)=O,325.0
c1ccc(-c2csc(-c3ccncc3)n2)cc1,ClCCl,376.0
c1ccc(-c2nc(-c3c[nH]c4ccccc34)n3ccccc23)cc1,C1CCCCC1,382.0
c1ccc(-c2nc(-c3c[nH]c4ccccc34)n3ccccc23)cc1,CC#N,381.0
c1ccc(-c2nc(-c3c[nH]c4ccccc34)n3ccccc23)cc1,CO,372.0
c1ccc(-c2nc(-c3c[nH]c4ccccc34)n3ccccc23)cc1,ClCCl,380.0
c1ccc(-c2nc(-c3c[nH]c4ccccc34)n3ccccc23)cc1,O,390.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-c5nc(-c6ccccc6)c(-c6ccccc6)o5)cc4)cc3)oc2-c2ccccc2)cc1,C1COCCO1,353.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,C1CCOC1,333.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,C1COCCO1,326.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CC#N,330.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CC(C)=O,333.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CC(C)OC(C)C,334.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CCCCCC,336.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CCCCOCCCC,336.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CCN(CC)CC,333.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CCOC(C)=O,332.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,CCOCC,333.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,Cc1ccccc1,338.0
c1ccc(-c2nc(-c3ccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)cn3)oc2-c2ccccc2)cc1,c1ccccc1,338.0
c1ccc(-c2nc(-c3ccc(-c4cccs4)s3)[nH]c2-c2ccccc2)cc1,CC#N,365.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,C1CCOC1,361.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,CC#N,356.5
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,CC(=O)O,360.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,CC(C)=O,360.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,CCOC(C)=O,359.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,CCOCC,359.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,CO,357.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,CS(C)=O,380.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1,ClC(Cl)Cl,358.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,C1CCOC1,385.9980314
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,CC#N,385.0
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,CC(=O)O,392.001568
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,CC(C)=O,384.5001925
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,CCOC(C)=O,385.0001925
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,CCOCC,383.99754244999997
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,CO,382.0000764
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)s3)[nH]c2-c2ccccc2)cc1,ClC(Cl)Cl,394.99575385
c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)o4)cc3)oc2-c2ccccc2)cc1,C1COCCO1,358.0
c1ccc(-c2nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n3ccccc23)cc1,C1CCCCC1,352.0
c1ccc(-c2nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n3ccccc23)cc1,CC#N,350.0
c1ccc(-c2nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n3ccccc23)cc1,CO,348.0
c1ccc(-c2nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n3ccccc23)cc1,ClCCl,353.0
c1ccc(-c2nc(-c3ccc(N(c4ccccc4)c4ccccc4)cc3)n3ccccc23)cc1,O,360.0
c1ccc(-c2nc(-c3ccc(N4CCCC4)cc3)cc(-c3ccc4ccccc4c3)n2)cc1,ClC(Cl)Cl,430.0
c1ccc(-c2nc(-c3ccc(N4c5ccccc5C(c5ccccc5)(c5ccccc5)c5ccccc54)cc3)cc(-c3ccccn3)n2)cc1,Cc1ccccc1,371.3286713
c1ccc(-c2nc(-c3ccc(N4c5ccccc5Sc5ccccc54)cc3)nn2-c2ccc(N3c4ccccc4Sc4ccccc43)cc2)nc1,ClCCl,377.0
c1ccc(-c2nc(-c3ccccc3)c(-c3ccccc3)o2)cc1,Cc1ccccc1,311.0
c1ccc(-c2nc(-c3ccccc3)c(N(c3ccccc3)c3ccccc3)[se]2)cc1,ClC(Cl)Cl,384.0
c1ccc(-c2nc(-c3ccccc3)c(N(c3ccccc3)c3ccccc3)s2)cc1,ClC(Cl)Cl,367.0
c1ccc(-c2nc(-c3ccccc3)n3ccccc23)cc1,C1CCCCC1,302.0
c1ccc(-c2nc(-c3ccccc3)n3ccccc23)cc1,CC#N,305.0
c1ccc(-c2nc(-c3ccccc3)n3ccccc23)cc1,CO,304.5
c1ccc(-c2nc(-c3ccccc3)n3ccccc23)cc1,ClC(Cl)Cl,308.0
c1ccc(-c2nc(-c3ccccc3)n3ccccc23)cc1,ClCCl,385.0
c1ccc(-c2nc(-c3ccccc3)n3ccccc23)cc1,O,305.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-n4c5ccccc5c5ccccc54)c(-n4c5ccccc5c5ncccc54)c(-n4c5ccccc5c5ccccc54)c3)n2)cc1,Cc1ccccc1,359.602649
c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-n4c5ccccc5c5ncccc54)c(-n4c5ccccc5c5ccccc54)c(-n4c5ccccc5c5ncccc54)c3)n2)cc1,Cc1ccccc1,376.5578635
c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-n4c5ccccc5c5ncccc54)c(-n4c5ccccc5c5ncccc54)c(-n4c5ccccc5c5ncccc54)c3)n2)cc1,Cc1ccccc1,362.2516556
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc6)ccc4N5c4ccccc4)cc3)n2)cc1,c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1,405.1106428
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4N5c4ccccc4)cc3)n2)cc1,c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1,387.776607
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4ccc5c(c4)[Si](c4ccccc4)(c4ccccc4)c4cc(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc6)ccc4N5c4ccccc4)cc3)n2)cc1,c1cc(-c2cccc(-n3c4ccccc4c4ccccc43)c2)cc(-n2c3ccccc3c3ccccc32)c1,402.1601686
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccc(-c6ccc7oc8ccccc8c7c6)cc5c5cc(-c6ccc7oc8ccccc8c7c6)ccc54)cc3)n2)cc1,Cc1ccccc1,377.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccc(-c6ccc7sc8ccccc8c7c6)cc5c5cc(-c6ccc7sc8ccccc8c7c6)ccc54)cc3)n2)cc1,Cc1ccccc1,377.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccc(-n6c7ccccc7c7ccccc76)cc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)n2)cc1,Cc1ccccc1,368.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c4c4ccccc4n5-c4ccccc4)cc3)n2)cc1,Cc1ccccc1,398.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)-c4ccccc4C6(c4ccccc4)c4ccccc4)cc3)n2)cc1,Cc1ccccc1,372.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5c6c(ccc54)C4(c5ccccc5-c5ccccc54)c4ccccc4-6)cc3)n2)cc1,Cc1ccccc1,374.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)n2)cc1,Cc1ccccc1,367.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)C4c5ccccc5C6c5ccccc54)cc3)n2)cc1,Cc1ccccc1,373.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccccc4)cc3)n2)cc1,Cc1ccccc1,403.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5cc6c7ccccc7n7c8ccccc8c(c54)c67)cc3)n2)cc1,Cc1ccccc1,383.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)cc3)n2)cc1,Cc1ccccc1,365.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)n2)cc1,Cc1ccccc1,364.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(N4c5ccccc5C5(c6ccccc64)c4ccccc4N(c4ccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)cc4)c4ccccc45)cc3)n2)cc1,Cc1ccccc1,400.0
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(N4c5ccccc5CCc5ccccc54)cc3)n2)cc1,Cc1ccccc1,366.6666667
c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(N4c5ccccc5[Si](c5ccccc5)(c5ccccc5)c5ccccc54)cc3)n2)cc1,Cc1ccccc1,376.6556291
c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)cc(-n5c6ccccc6c6ccccc65)c43)n2)cc1,C1CCOC1,332.6807229
c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-n5c6ccccc6c6ccccc65)ccc43)n2)cc1,C1CCOC1,321.2349398
c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cccc(-n5c6ccccc6c6ccccc65)c43)n2)cc1,C1CCOC1,321.2349398
c1ccc(-c2nc(-c3ccccn3)[se]c2N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,406.0
c1ccc(-c2nc(-c3ccccn3)sc2N(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,388.0
c1ccc(-c2nc(-c3cccs3)[nH]c2-c2ccccc2)cc1,CC#N,317.0
c1ccc(-c2nc3c(-c4c5ccccc5cc5ccccc45)ccc(-c4c5ccccc5cc5ccccc45)c3nc2-c2ccccc2)cc1,CS(C)=O,350.0
c1ccc(-c2nc3c(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)ccc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c3nc2-c2ccccc2)cc1,ClC(Cl)Cl,437.0
c1ccc(-c2nc3c(-c4ccccc4)sc(-c4ccccc4)c3nc2-c2ccccc2)cc1,Cc1ccccc1,488.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,C1CCOC1,314.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CC#N,308.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CCCCCC,309.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CCOC(C)=O,314.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CO,318.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,CS(C)=O,317.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,Cc1ccccc1,312.0
c1ccc(-c2nc3c(c4c2-c2ccccc2CC4)-c2ccccc2CC3)cc1,ClCCl,318.0
c1ccc(-c2nc3c(ccc4[nH]ccc43)o2)cc1,C1CCCCC1,331.0
c1ccc(-c2nc3c(ccc4[nH]ccc43)o2)cc1,C1COCCO1,333.0
c1ccc(-c2nc3c(ccc4[nH]ccc43)o2)cc1,CC#N,320.0
c1ccc(-c2nc3c(ccc4[nH]ccc43)o2)cc1,CO,325.0
c1ccc(-c2nc3c(ccc4[nH]ccc43)o2)cc1,Cc1ccccc1,322.0
c1ccc(-c2nc3c(ccc4[nH]ccc43)o2)cc1,O,321.0
c1ccc(-c2nc3c4ccccc4c4cccc2n43)cc1,CO,469.0
c1ccc(-c2nc3c4ccccc4c4ccccc4c3n2-c2ccccc2)cc1,C1CCOC1,362.0
c1ccc(-c2nc3cc4c(cc3n2-c2ccccc2)nc(-c2ccccc2)n4-c2ccccc2)cc1,CC#N,330.0
c1ccc(-c2nc3ccccc3nc2-c2cc(-c3nc4ccccc4nc3-c3ccccc3)cc(-n3c4ccccc4c4ccccc43)c2)cc1,Cc1ccccc1,340.0
c1ccc(-c2nc3ccccc3nc2-c2cc(-n3c4ccccc4c4ccccc43)cc(-n3c4ccccc4c4ccccc43)c2)cc1,Cc1ccccc1,335.0
c1ccc(-c2nc3ccccc3nc2-c2ccccc2)cc1,ClC(Cl)Cl,344.0
c1ccc(-c2nc3ccccc3s2)nc1,CO,300.0
c1ccc(-c2nc3nc4ccccc4nc3n2-c2ccccc2)cc1,CC#N,348.0
c1ccc(-c2nc3nccc(-c4ccccc4)n3n2)cc1,ClCCl,317.0
c1ccc(-c2nc3sc4cc5c(cc4c3s2)OCO5)cc1,CS(C)=O,359.0
c1ccc(-c2nc3sc4ccccc4c3s2)nc1,CS(C)=O,354.0
c1ccc(-c2ncc3ccccn23)cc1,CO,317.0
c1ccc(-c2ncc3ccccn23)cc1,ClC(Cl)Cl,317.0
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(-n5c6ccccc6c6ccccc65)cc4cc23)cc1,C1CCCCC1,419.1114837
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(-n5c6ccccc6c6ccccc65)cc4cc23)cc1,C1CCOC1,414.9377593
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(-n5c6ccccc6c6ccccc65)cc4cc23)cc1,CC#N,411.0152076
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(-n5c6ccccc6c6ccccc65)cc4cc23)cc1,CC(C)=O,412.0313144
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(-n5c6ccccc6c6ccccc65)cc4cc23)cc1,CCCCCl,415.9733777
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(-n5c6ccccc6c6ccccc65)cc4cc23)cc1,CCCCOCCCC,418.0602007
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(-n5c6ccccc6c6ccccc65)cc4cc23)cc1,CN(C)C=O,414.9377593
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(N(c5ccccc5)c5ccccc5)cc4cc23)cc1,C1CCCCC1,452.079566
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(N(c5ccccc5)c5ccccc5)cc4cc23)cc1,C1CCOC1,450.0450045
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(N(c5ccccc5)c5ccccc5)cc4cc23)cc1,CC#N,447.0272687
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(N(c5ccccc5)c5ccccc5)cc4cc23)cc1,CC(C)=O,448.0286738
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(N(c5ccccc5)c5ccccc5)cc4cc23)cc1,CCCCCl,451.059991
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(N(c5ccccc5)c5ccccc5)cc4cc23)cc1,CCCCOCCCC,451.059991
c1ccc(-c2nn(-c3ccccc3)c3nc4ccc(N(c5ccccc5)c5ccccc5)cc4cc23)cc1,CN(C)C=O,450.0450045
c1ccc(-c2nn(-c3ccccc3)c3nc4ccccc4cc23)cc1,C1CCCCC1,401.4452027
c1ccc(-c2nn(-c3ccccc3)c3nc4ccccc4cc23)cc1,C1CCOC1,398.5651654
c1ccc(-c2nn(-c3ccccc3)c3nc4ccccc4cc23)cc1,CC#N,396.8253968
c1ccc(-c2nn(-c3ccccc3)c3nc4ccccc4cc23)cc1,CC(C)=O,396.039604
c1ccc(-c2nn(-c3ccccc3)c3nc4ccccc4cc23)cc1,CCCCCl,398.7240829
c1ccc(-c2nn(-c3ccccc3)c3nc4ccccc4cc23)cc1,CCCCOCCCC,398.5651654
c1ccc(-c2nn(-c3ccccc3)c3nc4ccccc4cc23)cc1,CN(C)C=O,397.93076
c1ccc(-c2nn(-c3ccccn3)c3nc4ccccc4cc23)cc1,C1CCCCC1,385.0
c1ccc(-c2nn(-c3ccccn3)c3nc4ccccc4cc23)cc1,C1CCOC1,384.0
c1ccc(-c2nn(-c3ccccn3)c3nc4ccccc4cc23)cc1,CC#N,383.0
c1ccc(-c2nn(-c3ccccn3)c3nc4ccccc4cc23)cc1,CC(C)=O,383.0
c1ccc(-c2nn(-c3ccccn3)c3nc4ccccc4cc23)cc1,CCCCOCCCC,385.0
c1ccc(-c2nn(-c3ccccn3)c3nc4ccccc4cc23)cc1,CN(C)C=O,383.0
c1ccc(-c2nnc(-c3cc(-c4nnc(-c5ccccc5)o4)c(-n4c5ccccc5c5ccccc54)cc3-n3c4ccccc4c4ccccc43)o2)cc1,Cc1ccccc1,370.0
c1ccc(-c2nnc(-c3cc(-n4c5ccccc5c5ccccc54)c(-n4c5ccccc5c5ccccc54)cc3-c3nnc(-c4ccccc4)o3)o2)cc1,ClCCl,361.0
c1ccc(-c2nnc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)o2)cc1,Cc1ccccc1,340.0
c1ccc(-c2nnc(-c3ccn4nc(-c5ccc6ccccc6c5)cc4c3)o2)cc1,C1CCCCC1,351.0
c1ccc(-c2nnc(N=Nc3ccc(-c4cccs4)s3)s2)cc1,CS(C)=O,515.0
c1ccc(-c2nnc3ccccn23)cc1,ClCCl,282.0
c1ccc(-c2oc(-c3ccccc3)c3ccccc23)cc1,C1CCCCC1,411.0
c1ccc(-c2oc(-c3ccccc3)c3ccccc23)cc1,C1CCOC1,413.0
c1ccc(-c2oc(-c3ccccc3)c3ccccc23)cc1,CC#N,411.0
c1ccc(-c2oc(-c3ccccc3)c3ccccc23)cc1,CCO,411.0
c1ccc(-c2oc(-c3ccccc3)c3ccccc23)cc1,CN(C)C=O,415.0
c1ccc(-c2oc(-c3ccccc3)c3ccccc23)cc1,CS(C)=O,416.0
c1ccc(-c2oc(-c3ccccc3)c3ccccc23)cc1,Cc1ccccc1,414.0
c1ccc(-c2oc3cccc4[n+]3c2-c2ccccc2-4)cc1,ClCCl,368.0
c1ccc(-n2c(-c3c(-n4c5ccccc5c5ccccc54)cccc3-n3c4ccccc4c4ccccc43)nc3ccccc32)cc1,C1CCOC1,342.0
c1ccc(-n2c(-c3ccc(-c4c5ccccc5c(-c5cccc(-n6c7ccccc7c7ccccc76)c5)c5ccccc45)cc3)nc3c4ccccc4c4ccccc4c32)cc1,ClCCl,397.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,C1CCOC1,341.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,C1COCCO1,344.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,CC#N,337.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,CCCCCC,341.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,CCCCOCCCC,340.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,CCN(CC)CC,341.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,CCOC(C)=O,339.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,CCOCC,340.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,CN(C)C=O,342.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,Cc1ccccc1,345.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,ClC(Cl)Cl,340.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,ClC=C(Cl)Cl,343.0
c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6ccccc6)cc5)cc4)cc3)nc3ccccc32)cc1,ClCCl,340.0
c1ccc(-n2c(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-5)c5ccccc5-c5ccc(-c6ccc(-c7nc8ccccc8n7-c7ccccc7)cc6)c6cccc4c56)cc3)nc3ccccc32)cc1,ClC(Cl)Cl,325.0
c1ccc(-n2c(-c3ccc(-c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4cc(-c6ccc(-c7nc8ccccc8n7-c7ccccc7)cc6)c6ccccc6c4-5)cc3)nc3ccccc32)cc1,ClC(Cl)Cl,359.0
c1ccc(-n2c(-c3ccc(-c4nc(-c5ccc(-c6nc7ccccc7n6-c6ccccc6)cc5)c5ccccc5n4)cc3)nc3ccccc32)cc1,ClCCl,342.0
c1ccc(-n2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc3nccnc32)cc1,CC#N,339.0
c1ccc(-n2c(-c3ccc(N(c4ccc(-c5ccc(N(c6ccc(-c7nc8c9ccccc9c9ccccc9c8n7-c7ccccc7)cc6)c6ccc(-c7nc8c9ccccc9c9ccccc9c8n7-c7ccccc7)cc6)cc5)cc4)c4ccc(-c5nc6c7ccccc7c7ccccc7c6n5-c5ccccc5)cc4)cc3)nc3c4ccccc4c4ccccc4c32)cc1,ClCCl,376.0
c1ccc(-n2c(-c3cccc4ccccc34)nc3c4cccc5ccc6cccc(c6c54)c32)cc1,C1CCOC1,352.9859719
c1ccc(-n2c(-c3cccc4ccccc34)nc3c4cccc5ccc6cccc(c6c54)c32)cc1,Cc1ccccc1,380.0
c1ccc(-n2c(-c3cccc4ccccc34)nc3c4ccccc4c4ccccc4c32)cc1,Cc1ccccc1,356.0
c1ccc(-n2c(-c3ccccc3-n3c4ccccc4c4ccccc43)nc3ccccc32)cc1,C1CCOC1,352.0
c1ccc(-n2c3c(c4c2-c2ccccc2C42c4ccccc4-c4ccccc42)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)cc1,C1CCOC1,375.0
c1ccc(-n2c3ccccc3c3c2c2ccccc2n3-c2ccccc2)cc1,Cc1ccccc1,363.0
c1ccc(-n2c3ccccc3c3cc(-c4ccc5nc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)nn5c4)ccc32)cc1,C1CCOC1,340.0
c1ccc(-n2c3ccccc3c3cc(-c4cccc(-n5c6ccccc6c6c7sc8ccccc8c7ccc65)c4)ccc32)cc1,ClCCl,355.0
c1ccc(-n2c3ccccc3c3cc(-c4cccc(-n5c6ccccc6c6ncccc65)c4)ccc32)cc1,ClCCl,345.0
c1ccc(-n2c3ccccc3c3cc(-c4ccn5nc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)nc5c4)ccc32)cc1,C1CCOC1,341.0
c1ccc(-n2c3ccccc3c3cc(-c4nc(-c5cccc(-c6ccc7c8ccccc8c8ccccc8c7c6)c5)nc5ccccc45)ccc32)cc1,ClCCl,376.0
c1ccc(-n2c3ccccc3c3cc(-n4ccc5cc(-c6ccc(C7(c8ccccc8)c8ccccc8-c8ccccc87)cc6)ccc54)ccc32)cc1,ClCCl,308.0
c1ccc(-n2c3ccccc3c3cc(-n4ccc5cc(-c6cccc7c6-c6ccccc6C7(c6ccccc6)c6ccccc6)ccc54)ccc32)cc1,ClCCl,325.0
c1ccc(-n2c3ccccc3c3cc([Si](c4ccccc4)(c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)ccc32)cc1,ClCCl,342.0
c1ccc(-n2c3ccccc3c3ccccc32)cc1,C1CCCCC1,407.0
c1ccc(-n2cccc2)cc1,CC#N,252.0
c1ccc(-n2cccc2)cc1,CCCCCC,254.0
c1ccc(-n2cccc2)cc1,ClC(Cl)Cl,310.0
c1ccc(-n2nc(-c3ccc(-c4ccc5c(c4)C(c4ccccc4)(c4ccccc4)c4ccccc4-5)cc3)nc2-c2ccccn2)cc1,ClCCl,323.0
c1ccc(-n2nc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)nc2-c2ccccn2)cc1,ClCCl,341.0
c1ccc(-n2nc(-c3ccc(N4c5ccccc5Sc5ccccc54)cc3)nc2-c2ccccn2)cc1,ClCCl,329.0
c1ccc(-n2nc3ccccc3n2)cc1,CO,305.0
c1ccc(-p2c(-c3cccs3)cc3ccccc32)cc1,C1CCOC1,350.0
c1ccc(-p2c3ccccc3c3sc4ccccc4c32)cc1,C1CCCCC1,319.0
c1ccc(-p2c3ccccc3c3sc4ccccc4c32)cc1,CC#N,314.0
c1ccc(-p2c3ccccc3c3sc4ccccc4c32)cc1,CCO,314.0
c1ccc(-p2c3ccccc3c3sc4ccccc4c32)cc1,ClCCl,317.0
c1ccc(/C(=C(\c2ccccc2)c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-c3ccccc3)cc2)c2cc(-c3ccc(-c4ccccc4)cc3)ccc2-c2ccc(-c3ccccc3)cc2)cc1,C1CCOC1,302.0
c1ccc(/C(=C(\c2ccccc2)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccccc3)cc2)c2cc(-c3ccccc3)ccc2-c2ccc(-c3ccccc3)cc2)cc1,C1CCOC1,291.0
c1ccc(/C(=C(\c2ccccc2)c2cc(-c3ccccc3)ccc2-c2ccccc2)c2cc(-c3ccccc3)ccc2-c2ccccc2)cc1,C1CCOC1,275.0
c1ccc(/C(=C(\c2ccccc2)c2ccccc2-c2ccc(-c3ccccc3)cc2)c2ccccc2-c2ccc(-c3ccccc3)cc2)cc1,C1CCOC1,280.0
c1ccc(B2N(c3ccccc3)C(c3ccccc3)=C(c3ccccc3)N2c2ccccc2)cc1,C1CCOC1,398.0
c1ccc(B2Nc3cc4c(cc3-c3occc32)NB(c2ccccc2)c2ccoc2-4)cc1,ClCCl,388.0
c1ccc(B2Nc3cc4c(cc3-c3sc5ccccc5c32)NB(c2ccccc2)c2c-4sc3ccccc23)cc1,ClCCl,409.0
c1ccc(B2Nc3cc4c(cc3-c3sccc32)NB(c2ccccc2)c2ccsc2-4)cc1,ClCCl,405.0
c1ccc(B2Nc3cccc4c3-n3c2ccc3B(c2ccccc2)N4)cc1,ClCCl,331.0
c1ccc(B2Nc3ccccc3-c3ccccc32)cc1,C1CCCCC1,329.0
c1ccc(C(=C(c2ccccc2)c2ccc(-c3ccc(-c4nc5c(-c6ccc(-c7ccc(C(=C(c8ccccc8)c8ccccc8)c8ccccc8)cc7)cc6)sc(-c6ccc(-c7ccc(C(=C(c8ccccc8)c8ccccc8)c8ccccc8)cc7)cc6)c5nc4-c4ccc(-c5ccc(C(=C(c6ccccc6)c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)c2ccccc2)cc1,Cc1ccccc1,530.0
c1ccc(C(=C(c2ccccc2)c2ccc(-c3ccc(-c4nc5c(-c6ccc(-c7ccc(C(=C(c8ccccc8)c8ccccc8)c8ccccc8)cc7)cc6)sc(-c6ccc(-c7ccc(C(=C(c8ccccc8)c8ccccc8)c8ccccc8)cc7)cc6)c5nc4-c4ccc(-c5ccc(C(=C(c6ccccc6)c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)c2ccccc2)cc1,ClCCl,520.0
c1ccc(C(=C(c2ccccc2)c2ccc(-c3nc4c(-c5ccc(C(=C(c6ccccc6)c6ccccc6)c6ccccc6)cc5)sc(-c5ccc(C(=C(c6ccccc6)c6ccccc6)c6ccccc6)cc5)c4nc3-c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc2)cc1,Cc1ccccc1,538.0
c1ccc(C(=C(c2ccccc2)c2ccc(-c3nc4c(-c5ccc(C(=C(c6ccccc6)c6ccccc6)c6ccccc6)cc5)sc(-c5ccc(C(=C(c6ccccc6)c6ccccc6)c6ccccc6)cc5)c4nc3-c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)cc2)c2ccccc2)cc1,ClCCl,520.0
c1ccc(C2(c3ccccc3)c3cc4c(cc3-c3ccc5ccc6cccc7cc2c3c5c67)-c2ccc3ccc5cccc6cc(c2c3c56)C4(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,401.0
c1ccc(C2(c3ccccc3)c3cc4c(cc3-c3ccc5ccc6cccc7cc2c3c5c67)-c2ccc3ccc5cccc6cc(c2c3c56)C4(c2ccccc2)c2ccccc2)cc1,CC#N,400.0
c1ccc(C2(c3ccccc3)c3cc4c(cc3-c3ccc5ccc6cccc7cc2c3c5c67)-c2ccc3ccc5cccc6cc(c2c3c56)C4(c2ccccc2)c2ccccc2)cc1,CCOC(C)=O,400.0
c1ccc(C2(c3ccccc3)c3cc4c(cc3-c3ccc5ccc6cccc7cc2c3c5c67)-c2ccc3ccc5cccc6cc(c2c3c56)C4(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,404.0
c1ccc(C2(c3ccccc3)c3cc4c(cc3-c3ccc5ccc6cccc7cc2c3c5c67)-c2ccc3ccc5cccc6cc(c2c3c56)C4(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,404.0
c1ccc(C2(c3ccccc3)c3cc4c(cc3-c3sc5ccccc5c32)C(c2ccccc2)(c2ccccc2)c2c-4sc3ccccc23)cc1,C1CCOC1,394.0
c1ccc(C2(c3ccccc3)c3ccc4ccc5ccccc5c4c3-c3c2ccc2ccc4ccccc4c32)cc1,ClCCl,408.0
c1ccc(C2(c3ccccc3)c3ccccc3N(c3ccc(-c4nc([C@]56CC7CC(C[C@@H](C7)C5)C6)nc([C@]56C[C@@H]7C[C@H](C[C@H](C7)C5)C6)n4)cc3)c3ccccc32)cc1,Cc1ccccc1,367.0157068
c1ccc(C2=C(c3ccccc3)N3C(=C(c4ccccc4)c4cccc5c(-c6ccccc6)c(-c6ccccc6)[o+]c3c45)c3ccccc32)cc1,ClCCl,501.0
c1ccc(C2=C(c3ccccc3)[Si](c3ccccc3)(c3ccccc3)c3ccccc32)cc1,C1CCOC1,330.0
c1ccc(C2=C(c3ccccc3)c3ccc4c5c(c(-c6ccccc6)cc(c35)O2)OC(c2ccccc2)=C4c2ccccc2)cc1,ClCCl,497.0
c1ccc(C2=C(c3ccccc3)c3ccc4c5c(ccc(c35)O2)OC(c2ccccc2)=C4c2ccccc2)cc1,ClCCl,490.0
c1ccc(C2=C(c3ccccc3)c3cccc4c(-c5ccccc5)c5c6ccccc6c(-c6ccccc6)c(-c6ccccc6)[n+]5c(c34)O2)cc1,ClCCl,501.0
c1ccc(C2=C(c3ccccc3)c3cccc4c3c(cc3nc5cc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)c(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5nc34)O2)cc1,ClCCl,516.0
c1ccc(C2=C(c3ccccc3)c3cccc4c3c(cc3nc5cc(-c6ccccc6)c(-c6ccccc6)cc5nc34)O2)cc1,ClCCl,507.0
c1ccc(C2=C(c3ccccc3)c3cccc4c3c(cc3nc5ccccc5nc34)O2)cc1,ClCCl,494.0
c1ccc(C2=C(c3ccccc3)c3cccc4c5c(cc(c34)O2)=NC2CCCCC2N=5)cc1,ClCCl,431.0
c1ccc(C2=C(c3ccccn3)[Si](c3ccccc3)(c3ccccc3)c3ccccc32)cc1,ClCCl,339.0
c1ccc(C2=C3C4=C(C5=[N+]3[B-]3(Oc6ccccc65)Oc5ccccc5-c5c6c(c2n53)C2CCC6CC2)C2CCC4CC2)cc1,ClCCl,626.0
c1ccc(C2=C3c4ccccc4C4=[N+]3[B-]3(Oc5ccccc54)Oc4ccccc4-c4c5ccccc5c2n43)cc1,ClCCl,711.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,C1CCCCC1,403.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,C1CCOC1,405.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,C1COCCO1,405.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,CC#N,405.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,CC(C)=O,406.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,CCOC(C)=O,404.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,CCOCC,404.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,CN(C)C=O,407.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,CO,402.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,CS(C)=O,408.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,Cc1ccccc1,406.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,ClC(Cl)Cl,404.0
c1ccc(C2CCN3COc4c5ccccc5c5c6c7c(c2c3c46)C(c2ccccc2)CCN7CO5)cc1,ClCCl,405.0
c1ccc(C2CSC(c3c4ccc(=[N+]5CCCCC5)cc-4oc4cc(N5CCCCC5)ccc34)SC2)cc1,CO,584.5804989
c1ccc(C2c3ccc4ccc5ccccc5c4c3-c3c2ccc2ccc4ccccc4c32)cc1,ClCCl,401.0
c1ccc(CCCOc2cc(-c3ccccn3)nc(-c3ccccn3)c2)cc1,CC#N,277.0
c1ccc(CO[Si]23n4c5c6ccccc6c4/N=C4\N=C(/N=c6/c7ccccc7c(n62)=c2c6ccccc6c(n23)=N5)c2ccccc24)cc1,CN(C)C=O,658.0
c1ccc(COc2c(-c3ccccc3)cc(-c3ccccc3)c3ccc[nH+]c23)cc1,CO,376.0
c1ccc(COc2cc(C[n+]3ccc(-c4cc[n+](Cc5cc(OCc6ccccc6)cc(OCc6ccccc6)c5)cc4)cc3)cc(OCc3ccccc3)c2)cc1,CC#N,261.0
c1ccc(COc2ccc3c(c2)c2cccc4c(-c5ccccc5)nc3n42)cc1,CO,469.0
c1ccc(COc2ccc3c(c2)c2cccc4c(-c5cccs5)nc3n42)cc1,CO,469.0
c1ccc(C[n+]2cc3ccc4c[n+](Cc5ccccc5)cc5ccc(c2)c3c45)cc1,CC#N,421.0
c1ccc(Cc2c3ccc(=[N+]4CCCCC4)cc-3oc3cc(N4CCCCC4)ccc23)cc1,ClCCl,566.0
c1ccc(Cc2cc(-c3ccccc3N(c3ccccc3)c3ccccc3)c(Cc3ccccc3)cc2-c2ccccc2N(c2ccccc2)c2ccccc2)cc1,ClCCl,410.0
c1ccc(Cc2nc3c(ccc4c5ccccc5ccc43)[nH]2)cc1,CC#N,365.0
c1ccc(Cn2c3ccccc3c3c(-c4ccccc4)c4oc5ccccc5c4cc32)cc1,CCO,330.0
c1ccc(Cn2nc(-c3ccccc3)cc2-c2nnc(-c3ccccc3)o2)cc1,ClCCl,271.0
c1ccc(N(c2ccccc2)c2c3ccccc3c(N(c3ccccc3)c3ccccc3)c3ccccc23)cc1,Cc1ccccc1,461.0
c1ccc(N(c2ccccc2)c2c3ccccc3cc3ccccc23)cc1,Cc1ccccc1,428.0
c1ccc(N(c2ccccc2)c2cc(N(c3ccccc3)c3ccccc3)c3ccc4c(N(c5ccccc5)c5ccccc5)cc(N(c5ccccc5)c5ccccc5)c5ccc2c3c54)cc1,ClCCl,461.0
c1ccc(N(c2ccccc2)c2ccc(-c3cc(-c4ccccn4)nc(-c4ccccn4)c3)cc2)cc1,CN(C)C=O,289.0
c1ccc(N(c2ccccc2)c2ccc(-c3cc4cc5cc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)oc5cc4o3)cc2)cc1,ClCCl,358.0
c1ccc(N(c2ccccc2)c2ccc(-c3cc4cc5oc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)cc5cc4o3)cc2)cc1,ClCCl,376.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4cc(-c5ccccn5)nc(-c5ccccn5)c4)cc3)cc2)cc1,ClCCl,284.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(-c5ccc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)c5nsnc45)s3)cc2)cc1,ClC(Cl)Cl,530.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(-c5ccc([P+](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)cc1,CC#N,354.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(-c5ccc([P+](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)cc1,CO,353.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(-c5ccc([P+](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)cc1,ClCCl,364.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(-c5ccc([P+](c6ccccc6)(c6ccccc6)c6ccccc6)cc5)cc4)cc3)cc2)cc1,O,360.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(-c5cccs5)c5nsnc45)s3)cc2)cc1,ClC(Cl)Cl,495.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc(-c5ccncn5)s4)cc3)cc2)cc1,CC#N,385.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc([P+](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)cc2)cc1,CC#N,364.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc([P+](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)cc2)cc1,CO,365.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc([P+](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)cc2)cc1,ClCCl,379.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccc([P+](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)cc3)cc2)cc1,O,362.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4ccncn4)s3)cc2)cc1,CC#N,403.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4nc(-c5ccccn5)n(-c5ccccc5)n4)cc3)cc2)cc1,ClCCl,349.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc(-c4nc5ccccc5n4-c4ccccc4)cc3)cc2)cc1,C1CCOC1,355.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc([P+](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,CC#N,372.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc([P+](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,CO,375.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc([P+](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,ClCCl,387.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc([P+](c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc2)cc1,O,369.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)ccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)cc2)cc1,ClCCl,372.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)ccc5O4)c4ccccc4-c4ccccc43)cc2)cc1,ClCCl,345.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)C3(c5cc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)ccc5S4)c4ccccc4-c4ccccc43)cc2)cc1,ClCCl,356.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)C3(c5ccccc5Oc5ccccc53)c3cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc3-4)cc2)cc1,ClCCl,372.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4c(c3)C3(c5ccccc5Sc5ccccc53)c3cc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)ccc3-4)cc2)cc1,ClCCl,375.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4ccccc4[nH+]3)cc2)cc1,ClC(Cl)Cl,467.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4ccccc4n3)cc2)cc1,ClC(Cl)Cl,374.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccc4ccccc4n3)cc2)cc1,ClCCl,374.0
c1ccc(N(c2ccccc2)c2ccc(-c3ccncn3)cc2)cc1,ClCCl,367.0
c1ccc(N(c2ccccc2)c2ccc(-c3cnc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)s3)cc2)cc1,CO,398.0
c1ccc(N(c2ccccc2)c2ccc(-c3cnc(-c4ccncc4)s3)cc2)cc1,CO,403.0
c1ccc(N(c2ccccc2)c2ccc(-c3cncs3)cc2)cc1,CO,346.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)c4ccccc4n3)cc2)cc1,ClCCl,370.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)cc1,C1COCCN1,383.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)cc1,C1COCCO1,381.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)cc1,CC(=O)O,384.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)cc1,CCCCO,373.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5ccccc5c5ccccc5c4[nH]3)cc2)cc1,CCO,373.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc4c5ccccc5c5ccccc5c4n3-c3ccccc3)cc2)cc1,ClCCl,400.0
c1ccc(N(c2ccccc2)c2ccc(-c3nc4ccccc4s3)cc2)cc1,CO,310.0
c1ccc(N(c2ccccc2)c2ccc(-c3ncc(-c4ccc(-c5ccc(-c6cnc(-c7ccc(N(c8ccccc8)c8ccccc8)cc7)s6)s5)s4)s3)cc2)cc1,CO,425.0
c1ccc(N(c2ccccc2)c2ccc(-c3ncc(-c4ccc(-c5cnc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)s5)s4)s3)cc2)cc1,CO,421.0
c1ccc(N(c2ccccc2)c2ccc(-c3ncc(-c4cccs4)s3)cc2)cc1,CO,387.0
c1ccc(N(c2ccccc2)c2ccc(-c3ncc(-c4ccncc4)s3)cc2)cc1,CO,397.0
c1ccc(N(c2ccccc2)c2ccc(-c3ncc(-c4cnc(-c5ccc(N(c6ccccc6)c6ccccc6)cc5)s4)s3)cc2)cc1,CO,422.0
c1ccc(N(c2ccccc2)c2ccc(-c3ncnc4ccccc34)cc2)cc1,ClCCl,380.0
c1ccc(N(c2ccccc2)c2ccc(-n3ccc4cc(-c5ccc(C6(c7ccccc7)c7ccccc7-c7ccccc76)cc5)ccc43)cc2)cc1,ClCCl,308.0
c1ccc(N(c2ccccc2)c2ccc(-n3ccc4cc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccc5)ccc43)cc2)cc1,ClCCl,322.0
c1ccc(N(c2ccccc2)c2ccc(C(n3cccn3)n3cccn3)cc2)cc1,CN(C)C=O,301.0
c1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc4ccc5c(N(c6ccccc6)c6ccc(N(c7ccccc7)c7ccccc7)cc6)ccc6ccc3c4c65)cc2)cc1,ClCCl,438.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)c3ccccc23)cc1,CC#N,401.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)c3ccccc23)cc1,CO,401.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)c3ccccc23)cc1,ClCCl,407.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)c3ccccc23)cc1,O,394.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1,CC#N,333.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1,CO,334.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1,ClCCl,333.0
c1ccc(N(c2ccccc2)c2ccc([P+](c3ccccc3)(c3ccccc3)c3ccccc3)cc2)cc1,O,332.0
c1ccc(N(c2ccccc2)c2ccc3c(c2)[nH]c2cc(-c4ccncc4)ccc23)cc1,C1COCCO1,372.0
c1ccc(N(c2ccccc2)c2ccc3c(ccc4nc5ccc6cc(N(c7ccccc7)c7ccccc7)ccc6c5nc43)c2)cc1,C1CCCCC1,471.0
c1ccc(N(c2ccccc2)c2ccc3c(ccc4nc5ccc6cc(N(c7ccccc7)c7ccccc7)ccc6c5nc43)c2)cc1,C1CCOC1,474.0
c1ccc(N(c2ccccc2)c2ccc3c(ccc4nc5ccc6cc(N(c7ccccc7)c7ccccc7)ccc6c5nc43)c2)cc1,CN(C)C=O,477.0
c1ccc(N(c2ccccc2)c2ccc3c(ccc4nc5ccc6cc(N(c7ccccc7)c7ccccc7)ccc6c5nc43)c2)cc1,Cc1ccccc1,473.0
c1ccc(N(c2ccccc2)c2ccc3c(ccc4nc5ccc6cc(N(c7ccccc7)c7ccccc7)ccc6c5nc43)c2)cc1,ClCCl,476.0
c1ccc(N(c2ccccc2)c2ccc3c4cccc5c(N(c6ccccc6)c6ccccc6)ccc(c6cccc2c63)c54)cc1,C1CCCCC1,493.0
c1ccc(N(c2ccccc2)c2ccc3c4cccc5c(N(c6ccccc6)c6ccccc6)ccc(c6cccc2c63)c54)cc1,C1CCOC1,489.0
c1ccc(N(c2ccccc2)c2ccc3c4cccc5c(N(c6ccccc6)c6ccccc6)ccc(c6cccc2c63)c54)cc1,CC#N,483.0
c1ccc(N(c2ccccc2)c2ccc3c4cccc5c(N(c6ccccc6)c6ccccc6)ccc(c6cccc2c63)c54)cc1,Cc1ccccc1,492.0
c1ccc(N(c2ccccc2)c2ccc3c4cccc5c(N(c6ccccc6)c6ccccc6)ccc(c6cccc2c63)c54)cc1,ClCCl,490.0
c1ccc(N(c2ccccc2)c2ccc3ccc4c(N(c5ccccc5)c5ccccc5)ccc5ccc2c3c54)cc1,Cc1ccccc1,426.0
c1ccc(N(c2ccccc2)c2ccc3ccc4c(N(c5ccccc5)c5ccccc5)ccc5ccc2c3c54)cc1,ClCCl,423.0
c1ccc(N(c2ccccc2)c2ccccc2-c2cc(-c3cccc4ccccc34)c(-c3ccccc3N(c3ccccc3)c3ccccc3)cc2-c2cccc3ccccc23)cc1,ClCCl,419.0
c1ccc(N2N=C(c3c4ccccc4cc4ccccc34)CC2c2ccc3ccc4cccc5ccc2c3c45)cc1,ClCCl,425.0
c1ccc(N2N=C(c3cccc4ccccc34)CC2c2ccc3ccc4cccc5ccc2c3c45)cc1,ClCCl,391.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4cc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,511.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4cn[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,524.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,C1CCC2CCCCC2C1,542.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,C1CCCCC1,539.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,C1CCOC1,535.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,CC#N,527.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,CC(C)=O,530.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,CCCCCC,537.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,CCOC(C)=O,532.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,CN(C)C=O,532.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,Cc1ccccc1,539.0
c1ccc(N2c3ccc4ccccc4c3-c3c4ccccc4nc[n+]3[B-]2(c2ccccc2)c2ccccc2)cc1,ClC(Cl)Cl,541.0
c1ccc(N2c3ccccc3B3c4ccccc4N(c4ccccc4)c4cccc2c43)cc1,ClCCl,437.0
c1ccc(N2c3ccccc3C3(c4ccccc4-c4ccccc43)c3ccccc32)cc1,ClCCl,310.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,C1CCOC1,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CC#N,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CC(C)=O,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CC(C)OC(C)C,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CCCCCC,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CCCCOCCCC,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CCN(CC)CC,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CCOC(C)=O,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CCOCC,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,CN(C)C=O,407.0
c1ccc(N2c3ccccc3Sc3cc(-c4cccc5nc6ccccc6cc45)ccc32)cc1,ClCCl,407.0
c1ccc(N=Nc2nc3ccccc3s2)cc1,CO,332.0
c1ccc(Nc2ccc3ccccc3n2)cc1,CCO,350.0
c1ccc(Nc2ccc3ccccc3n2)cc1,CCOC(C)=O,349.0
c1ccc(Nc2ccc3ccccc3n2)cc1,Cc1ccccc1,348.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3cc4ccc5cccc6ccc(c3)c4c56)n2)cc1,CC#N,336.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3cc4ccc5cccc6ccc(c3)c4c56)n2)cc1,CCCCOCCCC,336.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3cc4ccc5cccc6ccc(c3)c4c56)n2)cc1,CO,336.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4c5cccc6cccc(c7cccc3c74)c65)n2)cc1,C1COCCO1,444.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4c5cccc6cccc(c7cccc3c74)c65)n2)cc1,CC#N,444.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4c5cccc6cccc(c7cccc3c74)c65)n2)cc1,CCCCOCCCC,444.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4c5cccc6cccc(c7cccc3c74)c65)n2)cc1,CCOC(C)=O,443.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4cc5ccccc5cc4c3)n2)cc1,C1COCCO1,402.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4cc5ccccc5cc4c3)n2)cc1,CC#N,401.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4cc5ccccc5cc4c3)n2)cc1,CCCCOCCCC,402.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4cc5ccccc5cc4c3)n2)cc1,CCOC(C)=O,402.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4ccc5cccc6ccc3c4c56)n2)cc1,CC#N,342.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4ccc5cccc6ccc3c4c56)n2)cc1,CCCCOCCCC,342.0
c1ccc(Nc2nc(Nc3ccccc3)nc(Nc3ccc4ccc5cccc6ccc3c4c56)n2)cc1,CO,340.0
c1ccc(Nc2ncnc3ccc(-c4ccccc4)cc23)cc1,ClC(Cl)Cl,344.0
c1ccc(Oc2cc3c4c([n+]5c(-c6ccccc6)c(-c6ccccc6)c6ccccc6c5c(-c5ccccc5)c4c2)OC(c2ccccc2)=C3c2ccccc2)cc1,ClCCl,476.0
c1ccc(Oc2ccc(-c3cccc4c3n[n+](-c3ccccc3)c3cc(Oc5ccccc5)ccc43)cc2)cc1,ClCCl,544.0
c1ccc(P(CCCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1,C1CCOC1,456.0
c1ccc(P(CCCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1,ClCCl,475.0
c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1,ClCCl,447.0
c1ccc(P(CP(c2ccccc2)c2ccccc2)c2ccccc2)cc1,C1CCOC1,431.0
c1ccc([B-]2(c3ccccc3)Oc3ccc4ccccc4c3-c3c4ccccc4cc[n+]32)cc1,Cc1ccccc1,427.0
c1ccc([B-]23NC(C4CCCCC4)=Nc4cccc([n+]42)N=C(C2CCCCC2)N3)cc1,ClCCl,416.0
c1ccc([B-]23Oc4ccccc4-c4c5[n+]6c(c([n+]42)-c2ccccc2O3)-c2ccccc2O[B-]6(c2ccccc2)Oc2ccccc2-5)cc1,ClCCl,574.0
c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc(-c3cc(-c4ccc([Si](c5ccccc5)(c5ccccc5)c5ccccc5)cc4)c4ccc5c(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)cc(-c6ccc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)cc6)c6ccc3c4c65)cc2)cc1,CCCCCC,408.0
c1ccc([Si]2(c3ccccc3)c3ccccc3-c3cc4c(cc32)-c2ccccc2[Si]4(c2ccccc2)c2ccccc2)cc1,ClCCl,328.0
c1ccc2[nH]c(-c3cc(-c4nc5ccccc5[nH]4)cc(-c4nc5ccccc5[nH]4)c3)nc2c1,CS(C)=O,316.0
c1ccc2[nH]c(-c3ccc(-c4ccc(-c5ccc(-c6nc7ccccc7[nH]6)cc5)cc4)cc3)nc2c1,CN(C)C=O,349.0
c1ccc2[nH]c(-c3ccncc3)nc2c1,CN(C)C=O,314.0
c1ccc2[nH]ncc2c1,C1CCCCC1,294.0
c1ccc2c(-c3c4ccccc4c(-c4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)c4ccccc34)cccc2c1,ClCCl,376.0
c1ccc2c(-c3cc(-c4c5ccccc5cc5ccccc45)cc(-c4c5ccccc5cc5ccccc45)c3)c3ccccc3cc2c1,C1CCOC1,389.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)c3ccccc3cc2c1,CC#N,385.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)c3ccccc3cc2c1,CCCCCC,383.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)c3ccccc3cc2c1,CO,382.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)c3ccccc3cc2c1,ClC(Cl)Cl,387.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)cccc2c1,CC#N,324.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)cccc2c1,CCCCCC,325.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)cccc2c1,CO,325.0
c1ccc2c(-c3cc(-c4nccs4)nc(-c4nccs4)c3)cccc2c1,ClC(Cl)Cl,330.0
c1ccc2c(-c3cc4c(ccc5sc(-c6cccc7ccccc67)cc54)s3)cccc2c1,ClCCl,333.0
c1ccc2c(-c3cc4c(ccc5sccc54)s3)cccc2c1,ClCCl,307.0
c1ccc2c(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)cncc2c1,C1CCOC1,370.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,C1COCCO1,357.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CC#N,354.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CC(=O)N(C)C,359.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CCCCCCCCCCO,362.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CCCCCCCCO,359.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CCCCCCO,360.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CCCCO,356.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CCO,357.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,CS(C)=O,360.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,Cc1ccccc1,360.0
c1ccc2c(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cccc9ccccc89)s7)o6)cc5)o4)s3)cccc2c1,ClC(Cl)Cl,357.0
c1ccc2c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c3c(nc2c1)-c1cc2c(cc1CC3)-c1nc3ccccc3c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c1CC2,ClC(Cl)Cl,377.0
c1ccc2c(-c3ccncc3)c3c(nc2c1)-c1cc2c(cc1CC3)-c1nc3ccccc3c(-c3ccncc3)c1CC2,ClC(Cl)Cl,376.0
c1ccc2c(-c3cncnc3)c3ccccc3c(-c3cncnc3)c2c1,CCO,394.0
c1ccc2c(-c3cncnc3)c3ccccc3c(-c3cncnc3)c2c1,ClCCl,397.0
c1ccc2c(-c3nc4sc5ccccc5c4s3)cccc2c1,CS(C)=O,350.0
c1ccc2c(-c3nnc4ccccn34)cccc2c1,ClCCl,295.0
c1ccc2c(-c3scc4c3OCCO4)c3ccccc3cc2c1,ClCCl,370.0
c1ccc2c(-n3c(-c4ccc(-c5ccc(-c6nc7c8ccccc8c8ccccc8c7n6-c6cccc7ccccc67)c6ccccc56)c5ccccc45)nc4c5ccccc5c5ccccc5c43)cccc2c1,ClCCl,334.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,C1CCCCC1,321.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,C1CCOC1,323.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,CC#N,322.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,CCO,325.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,CCOC(C)=O,323.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,CCOCC,322.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,CO,323.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,Cc1ccccc1,321.0
c1ccc2c(-n3c4ccccc4c4ccccc43)cccc2c1,ClC(Cl)Cl,324.0
c1ccc2c(-n3cccc3)cccc2c1,ClC(Cl)Cl,356.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,C1CCCCC1,283.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,C1CCOC1,282.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,CC#N,286.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,CCO,284.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,CCOC(C)=O,283.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,CCOCC,284.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,CO,284.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,Cc1ccccc1,282.0
c1ccc2c(-n3cnc4ccccc43)cccc2c1,ClC(Cl)Cl,285.0
c1ccc2c(B(c3c4ccccc4cc4ccccc34)c3c4ccccc4cc4ccccc34)c3ccccc3cc2c1,C1CCOC1,394.4257
c1ccc2c(C3=C(c4cccc5ccccc45)c4cccc5c4c(cc4nc6ccccc6nc45)O3)cccc2c1,ClCCl,486.0
c1ccc2c(P(c3c4ccccc4cc4ccccc34)c3c4ccccc4cc4ccccc34)c3ccccc3cc2c1,C1CCOC1,437.0
c1ccc2c([SiH](c3c4ccccc4cc4ccccc34)c3c4ccccc4cc4ccccc34)c3ccccc3cc2c1,ClC(Cl)Cl,401.0
c1ccc2c(c1)-c1c(ccc3ccccc13)C21c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(-c3ccc4ccc5cccc6ccc3c4c56)cc21,ClC(Cl)Cl,364.0
c1ccc2c(c1)-c1cc(-n3c4ccccc4c4ccccc43)ccc1C21c2ccccc2-n2c3ccccc3c3cccc1c32,ClCCl,339.0
c1ccc2c(c1)-c1cccc3c1B1N2c2ccccc2N1c1ccccc1-3,ClCCl,346.0
c1ccc2c(c1)-c1cccc3cccc-2c13,CCOC(C)=O,394.0
c1ccc2c(c1)-c1cccc3oc(-c4ccc5ccccc5c4)c-2[n+]13,ClCCl,410.0
c1ccc2c(c1)-c1ccccc1C2(c1ccc(-n2c3ccccc3c3ccccc32)cc1)c1ccc(-n2c3ccccc3c3ccccc32)cc1,ClCCl,431.0
c1ccc2c(c1)-c1ccccc1C21c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(-c3ccc4ccc5cccc6ccc3c4c56)cc21,ClC(Cl)Cl,364.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2c(-c3ccncc3)cccc21,C1CCCCC1,308.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2c1c1c3ccccc3ccc1c1ccccc21,C1CCOC1,377.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccc(-c3ccncc3)cc21,C1CCCCC1,321.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ccncc21,CC1CCCO1,307.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cnccc21,CC1CCCO1,305.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2ncccc21,CC1CCCO1,314.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2oc3c(c21)C1(c2ccccc2-c2ccccc21)c1ccccc1-3,C1CCOC1,367.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2sc3c(c21)C1(c2ccccc2-c2ccccc21)c1ccccc1-3,C1CCOC1,373.0
c1ccc2c(c1)-c1ccccc1C21c2ccccc2N(c2ccc(-c3nc([C@]45CC6CC(C[C@@H](C6)C4)C5)nc([C@]45C[C@@H]6C[C@H](C[C@H](C6)C4)C5)n3)cc2)c2ccccc21,Cc1ccccc1,380.104712
c1ccc2c(c1)-c1ccccc1N1B3c4c(cccc4-c4ccccc41)-c1ccccc1N32,ClCCl,367.0
c1ccc2c(c1)-c1ccccc1[Si]21c2ccccc2-c2cc3c(cc21)-c1ccccc1[Si]31c2ccccc2-c2ccccc21,ClCCl,329.0
c1ccc2c(c1)-c1sc3ccccc3c1C21c2ccccc2-c2sc3ccccc3c21,ClCCl,340.0
c1ccc2c(c1)B1c3ccccc3-c3ccc4c5c3N1C1=C2c2ccccc2B(c2ccccc2-4)N15,ClCCl,411.0
c1ccc2c(c1)CC1(C2)c2cc(N3c4ccccc4Sc4ccccc43)ccc2-c2ccc(N3c4ccccc4Sc4ccccc43)cc21,Cc1ccccc1,310.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,C1CCOC1,323.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,CC#N,322.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,CCCCCC,323.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,CCOC(C)=O,315.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,CO,324.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,CS(C)=O,325.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,Cc1ccccc1,323.0
c1ccc2c(c1)CCc1c-2cnc2c1-c1ccccc1CC2,ClCCl,322.0
c1ccc2c(c1)CCc1ccccc1N2,CC#N,290.0
c1ccc2c(c1)CCc1ccccc1N2,CCCCCC,285.0
c1ccc2c(c1)CCc1ccccc1N2,CO,290.0
c1ccc2c(c1)CCc1ccccc1N2c1c2ccccc2c(N2c3ccccc3CCc3ccccc32)c2ccccc12,Cc1ccccc1,456.0
c1ccc2c(c1)CCc1ccccc1N2c1c2ccccc2cc2ccccc12,Cc1ccccc1,426.0
c1ccc2c(c1)Cc1c-2sc2c1Cc1ccccc1-2,C1CCOC1,354.0
c1ccc2c(c1)Cc1ccccc1N2c1c2ccccc2c(N2c3ccccc3Cc3ccccc32)c2ccccc12,Cc1ccccc1,440.0
c1ccc2c(c1)Cc1ccccc1N2c1c2ccccc2cc2ccccc12,Cc1ccccc1,416.0
c1ccc2c(c1)Cc1nc3nc4ccccc4cc3cc1-2,CC(C)=O,371.0
c1ccc2c(c1)NB1Nc3ccccc3-c3cccc-2c31,ClCCl,351.0
c1ccc2c(c1)Nc1ccccc1B2c1c2ccccc2cc2ccccc12,ClCCl,394.0
c1ccc2c(c1)Nc1ccccc1B2c1c2ccccc2cc2ccccc12,c1ccccc1,394.0
c1ccc2c(c1)Nc1ccccc1S2,CC#N,318.0
c1ccc2c(c1)Nc1ccccc1S2,CO,318.0
c1ccc2c(c1)OB1Oc3ccccc3-c3c1c-2c1c2c3-c3ccccc3OB2Oc2ccccc2-1,ClCCl,405.0
c1ccc2c(c1)OP1(=NP3(=NP(Oc4ccc5ccc6cccc7ccc4c5c67)(Oc4ccc5ccc6cccc7ccc4c5c67)=N1)Oc1ccccc1-c1ccccc1O3)Oc1ccccc1-2,ClCCl,343.0
c1ccc2c(c1)Oc1ccccc1C21c2cc(-c3ccc4ccc5cccc6ccc3c4c56)ccc2-c2ccc(-c3ccc4ccc5cccc6ccc3c4c56)cc21,ClC(Cl)Cl,364.0
c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3cccnc3nc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)cc1,Cc1ccccc1,438.0
c1ccc2c(c1)Oc1ccccc1N2c1ccc(-c2nc3ccncc3nc2-c2ccc(N3c4ccccc4Oc4ccccc43)cc2)cc1,Cc1ccccc1,437.0
c1ccc2c(c1)Oc1ccccc1N2c1ccc2c(c1)c1ccccc1n1c3ccccc3nc21,Cc1ccccc1,376.0
c1ccc2c(c1)Sc1ccccc1N2c1ccc2c(c1)C1(CC1)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,Cc1ccccc1,307.0
c1ccc2c(c1)Sc1ccccc1N2c1ccc2c(c1)C1(CCCC1)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,Cc1ccccc1,308.0
c1ccc2c(c1)Sc1ccccc1N2c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cc(N3c4ccccc4Sc4ccccc43)ccc1-2,Cc1ccccc1,309.0
c1ccc2c(c1)[nH]c1c(-c3ccc4nc(Nc5ccc6cc(-c7cccc8c7[nH]c7ccccc78)ccc6n5)ccc4c3)cccc12,ClCCl,458.0
c1ccc2c(c1)[nH]c1c3[nH]c4ccccc4c3c3nsnc3c21,CN(C)C=O,410.0
c1ccc2c(c1)[nH]c1c3[nH]c4ccccc4c3c3nsnc3c21,Cc1ccccc1,410.0
c1ccc2c(c1)[nH]c1c3[nH]c4ccccc4c3c3nsnc3c21,ClCCl,410.0
c1ccc2c(c1)[nH]c1ccccc12,CC#N,334.0
c1ccc2c(c1)[nH]c1ccccc12,CCCCCC,331.0
c1ccc2c(c1)[nH]c1cccnc12,C1CCCCC1,336.0
c1ccc2c(c1)[nH]c1cccnc12,C1CCOC1,341.0
c1ccc2c(c1)[nH]c1cccnc12,C1COCCO1,338.0
c1ccc2c(c1)[nH]c1cccnc12,CCO,334.0
c1ccc2c(c1)[nH]c1cccnc12,CN(C)C=O,344.0
c1ccc2c(c1)[nH]c1cccnc12,Cc1ccccc1,338.0
c1ccc2c(c1)[nH]c1cccnc12,ClC(Cl)Cl,339.0
c1ccc2c(c1)[nH]c1cccnc12,Clc1ccccc1,338.0
c1ccc2c(c1)c1cc(N3CCOCC3)ccc1c1nc3c4cccnc4c4ncccc4c3nc21,O=C(O)C(F)(F)F,446.0
c1ccc2c(c1)c1ccc3cccc4c3c1c2c1c2cccc3ccc5c6ccccc6c(c5c32)c41,ClCCl,625.0
c1ccc2c(c1)c1cccc3cnc2n31,CO,421.0
c1ccc2c(c1)c1ccccc1c1[nH]c(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)nc21,C1CCOC1,411.0
c1ccc2c(c1)c1ccccc1c1[nH]c(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)nc21,CC#N,412.0
c1ccc2c(c1)c1ccccc1c1[nH]c(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)nc21,CCO,410.0
c1ccc2c(c1)c1ccccc1c1[nH]c(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)nc21,CS(C)=O,410.0
c1ccc2c(c1)c1ccccc1c1[nH]c(-c3ccc(-c4nc5c6ccccc6c6ccccc6c5[nH]4)cc3)nc21,ClCCl,413.0
c1ccc2c(c1)c1ccccc1c1ccccc21,ClCCl,286.0
c1ccc2c(c1)c1ccccc1c1ncncc21,ClCCl,346.0
c1ccc2c(c1)c1ccccc1n1cccc21,CC#N,329.0
c1ccc2c(c1)c1ccccc1n1ccnc21,CC#N,306.0
c1ccc2c(c1)c1ccccc1n2-c1cc(-c2nc3ccccn3n2)cc(-n2c3ccccc3c3ccccc32)c1,Cc1ccccc1,338.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc3cc4oc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4cc3o2)cc1,ClCCl,372.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc3ccc(-c4ccc5cc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)oc5c4)cc3o2)cc1,Cc1ccccc1,365.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc3ccc(-c4ccc5cc(-c6ccc(-n7c8ccccc8c8ccccc87)cc6)oc5c4)cc3o2)cc1,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,376.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-c3ccc(-c4ccncn4)s3)cc2)cc1,CS(C)=O,368.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)nc3-n3c4ccccc4c4ccccc43)nn2)c(-n2c3ccccc3c3ccccc32)n1,CC#N,336.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)nc3-n3c4ccccc4c4ccccc43)nn2)c(-n2c3ccccc3c3ccccc32)n1,Cc1ccccc1,348.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)nc3-n3c4ccccc4c4ccccc43)nn2)c(-n2c3ccccc3c3ccccc32)n1,ClCCl,341.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)nc2-n2c3ccccc3c3ccccc32)nn1,CC#N,335.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)nc2-n2c3ccccc3c3ccccc32)nn1,Cc1ccccc1,346.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)nc2-n2c3ccccc3c3ccccc32)nn1,ClCCl,337.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)nn3c2)cc1,C1CCOC1,341.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccn3nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)nc3c2)cc1,C1CCOC1,342.0
c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2nnc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)o2)cc1,Cc1ccccc1,343.0
c1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)c1ccccc1n2-c1ccc(-n2c3ccccc3c3cc(-n4c5ccccc5c5ccccc54)ccc32)cc1,C1CCOC1,341.0
c1ccc2c(c1)c1ccccc1n2-c1ccc2cc(-c3ccc(-c4ccc(-c5cc6ccc(-n7c8ccccc8c8ccccc87)cc6o5)cc4)cc3)oc2c1,Cc1ccccc1,369.0
c1ccc2c(c1)c1ccccc1n2-c1ccc2cc(-c3ccc(-c4ccc(-c5cc6ccc(-n7c8ccccc8c8ccccc87)cc6o5)cc4)cc3)oc2c1,c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1,380.0
c1ccc2c(c1)cc(-c1cc(-c3nccs3)nc(-c3nccs3)c1)c1ccccc12,CC#N,325.0
c1ccc2c(c1)cc(-c1cc(-c3nccs3)nc(-c3nccs3)c1)c1ccccc12,CCCCCC,324.0
c1ccc2c(c1)cc(-c1cc(-c3nccs3)nc(-c3nccs3)c1)c1ccccc12,CO,326.0
c1ccc2c(c1)cc(-c1cc(-c3nccs3)nc(-c3nccs3)c1)c1ccccc12,ClC(Cl)Cl,330.0
c1ccc2c(c1)cc1c3cc4ccccc4c4cccc(c5cccc2c51)c43,Cc1ccccc1,430.0
c1ccc2c(c1)cc1c3ccccc3c3cc4ccccc4c4ccc2c1c43,ClCCl,385.0
c1ccc2c(c1)cc1c3ccccc3c3ccccc3n21,CC#N,359.0
c1ccc2c(c1)cc1ccc3c4cc5cc6ccc7c8ccccc8cc8ccc(c5cc4cc4ccc2c1c43)c6c87,Clc1ccccc1Cl,620.0
c1ccc2c(c1)cc1ccc3cc4c5ccccc5cc5ccc6cc2c1c3c6c54,Cc1ccccc1,461.0
c1ccc2c(c1)ccc1c2c2ncc3cccc1n32,CO,469.0
c1ccc2c(c1)ccc1c3ccccc3ccc21,ClCCl,322.0
c1ccc2c(c1)ccc1ccc3c(c12)-c1c(ccc2ccc4ccccc4c12)C3,ClCCl,400.0
c1ccc2c(c1)ccc1ccc3ccc4ccc5ccccc5c4c3c12,ClCCl,435.0
c1ccc2c(c1)ccc1ccc3ccc4ccccc4c3c12,ClC(Cl)Cl,393.0
c1ccc2c(c1)ccc1ccccc12,C1CCCCC1,295.5
c1ccc2c(c1)ccc1ccccc12,Cc1ccccc1,295.0
c1ccc2c(c1)ccc1ncc3ccc4cnccc4c3c12,CC#N,403.0
c1ccc2c(c1)ccc1oc3ccc4cc5oc6ccc7ccc8oc9ccc%10ccccc%10c9c8c7c6c5cc4c3c12,CC#N,352.0
c1ccc2c(c1)cnc1ccccc12,CCOC(C)=O,462.0
c1ccc2c(c1)nc1c3c4ccccc4c4ccccc4c3c3ccccc3n21,CC#N,373.0
c1ccc2c(c1)nc1c3ccccc3c3c4ccccc4sc3n21,CC#N,325.0
c1ccc2c(c1)nc1c3ccccc3c3cccnc3n21,CC#N,330.0
c1ccc2c(c1)nc1c3ccccc3c3nccnc3n21,CC#N,354.0
c1ccc2c(c1)nc1ccc3ccncc3n12,CCO,344.0
c1ccc2c(c1)nc1ccccn12,CC#N,344.0
c1ccc2c(c1)ncc1ccc3cnc4ccccc4c3c12,CC#N,397.0
c1ccc2c(c1)oc1ccccc12,CCOC(C)=O,393.0
c1ccc2c(c1)oc1nc3oc4ccc(-n5c6ccccc6c6cc(-n7c8ccccc8c8ccccc87)ccc65)cc4c3cc12,ClC(Cl)Cl,354.0
c1ccc2c(c1)oc1nc3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c3cc12,ClC(Cl)Cl,346.0
c1ccc2c3[nH]c(c2c1)N=c1[nH]c(c2ccccc12)=Nc1[nH]c(c2ccccc12)N=c1[nH]c(c2ccccc12)=N3,O,684.0
c1ccc2c3c(ccc2c1)-c1c2ccccc2cc2cccc-3c12,CCCCCCC,449.0
c1ccc2c3c(ccc2c1)-c1cc2ccccc2c2cccc-3c12,CCCCCCC,381.0
c1ccc2c3c(ccc2c1)-c1cccc2c1c-3cc1ccccc12,CCCCCCC,383.0
c1ccc2c3c(ccc2c1)C1(c2cc(-c4ccc5ccc6cccc7ccc4c5c67)ccc2-c2ccc(-c4ccc5ccc6cccc7ccc4c5c67)cc21)c1ccc2ccccc2c1O3,ClC(Cl)Cl,365.0
c1ccc2c[n+]3ccccc3cc2c1,O,396.0
c1ccc2cc(-c3c4ccccc4c(-c4ccc(-c5ccc(-n6c7ccccc7c7ccccc76)cc5)cc4)c4ccccc34)ccc2c1,ClCCl,377.0
c1ccc2cc(-c3c4ccccc4c(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c4ccccc34)ccc2c1,ClCCl,377.0
c1ccc2cc(-c3cc(-c4nccs4)nc(-c4nccs4)c3)ccc2c1,CC#N,323.0
c1ccc2cc(-c3cc(-c4nccs4)nc(-c4nccs4)c3)ccc2c1,CCCCCC,333.0
c1ccc2cc(-c3cc(-c4nccs4)nc(-c4nccs4)c3)ccc2c1,CO,333.0
c1ccc2cc(-c3cc(-c4nccs4)nc(-c4nccs4)c3)ccc2c1,ClC(Cl)Cl,329.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,C1CCCCC1,318.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,C1CCOC1,320.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,CC#N,321.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,CCO,320.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,CCOC(C)=O,318.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,CCOCC,319.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,CO,319.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,Cc1ccccc1,319.0
c1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1,ClC(Cl)Cl,321.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,C1CCCCC1,275.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,C1CCOC1,277.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,CC#N,278.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,CCO,277.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,CCOC(C)=O,278.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,CCOCC,276.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,CO,275.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,Cc1ccccc1,275.0
c1ccc2cc(-n3cnc4ccccc43)ccc2c1,ClC(Cl)Cl,276.0
c1ccc2cc3c(cc2c1)-c1cccc2cc4ccccc4c-3c12,CCCCCCC,469.0
c1ccc2cc3c(cc2c1)cc1c2cccc4c5cc6ccccc6cc5cc(c5cccc3c51)c42,Cc1ccccc1,444.0
c1ccc2cc3c(cc2c1)cc1ccc2c4cc5ccccc5cc4cc4ccc3c1c42,Cc1ccccc1,573.0
c1ccc2cc3c(cc2c1)cc1ccc2cc4c5cc6ccccc6cc5cc5ccc6cc3c1c2c6c54,Cc1ccccc1,542.0
c1ccc2cc3c(cc2c1)oc1c2oc4cc5ccccc5cc4c2c2ccccc2c31,C1CCOC1,395.0
c1ccc2cc3c4c(ccc3cc2c1)-c1cccc2cccc-4c12,CCCCCCC,407.0
c1ccc2cc3cc(-c4cc(-c5nccs5)nc(-c5nccs5)c4)ccc3cc2c1,CC#N,305.0
c1ccc2cc3cc(-c4cc(-c5nccs5)nc(-c5nccs5)c4)ccc3cc2c1,CCCCCC,375.0
c1ccc2cc3cc(-c4cc(-c5nccs5)nc(-c5nccs5)c4)ccc3cc2c1,CO,356.0
c1ccc2cc3cc(-c4cc(-c5nccs5)nc(-c5nccs5)c4)ccc3cc2c1,ClC(Cl)Cl,394.0
c1ccc2cc3cc4c(cc3cc2c1)-c1cccc2cccc-4c12,CCCCCCC,439.0
c1ccc2cc3ccccc3cc2c1,C1CCOC1,358.0
c1ccc2cc3ccccc3cc2c1,CO,355.0
c1ccc2cc3cnccc3cc2c1,CCO,371.0575139
c1ccc2nc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1,Cc1ccccc1,368.0
c1ccc2nc(-n3c4ccccc4c4ccccc43)c(-n3c4ccccc4c4ccccc43)nc2c1,Cc1ccccc1,404.0
c1ccc2nc3c(nc2c1)c1c2n3CCCN2CCCC1,CC#N,419.0
c1ccc2nc3c(nc2c1)c1c2n3CCCN2CCCC1,CCCCCC,408.0
c1ccc2nc3c(nc2c1)c1c2n3CCCN2CCCC1,CS(C)=O,441.0
c1ccc2nc3c(nc2c1)c1ccccc1c1nc2ccccc2n13,CC#N,396.0
c1ccc2nc3c4cccnc4c4ncccc4c3nc2c1,CC#N,411.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,C1CCOC1,359.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,CC#N,358.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,CC(C)=O,358.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,CC(C)OC(C)C,359.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,CCCCCC,359.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,CCCCOCCCC,359.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,CCOC(C)=O,359.0
c1ccc2nc3cccc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)c3cc2c1,CCOCC,358.0
c1ccc2nc3nc4c(cc3cc2c1)CCCC4,CN(C)C=O,362.0
c1ccc2ocnc2c1,CN(C)C=O,390.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,C1COCCO1,343.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CC#N,340.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CC(=O)N(C)C,343.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CCCCCCCCCCO,345.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CCCCCCCCO,345.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CCCCCCO,343.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CCCCO,341.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CCO,345.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,CS(C)=O,344.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,Cc1ccccc1,347.0
c1ccc2sc(-c3ccc(-c4nnc(-c5ccc(-c6nnc(-c7ccc(-c8cc9ccccc9s8)s7)o6)cc5)o4)s3)cc2c1,ClC(Cl)Cl,346.0
c1ccc2sc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)nc2c1,CO,345.0
c1ccc2sc(N=Nc3nc4ccccc4s3)nc2c1,CC#N,427.0
c1ccc2scnc2c1,CN(C)C=O,392.0
c1ccn(-c2ccc(-c3cc(-c4ccc(-n5cccc5)cc4)cc(-c4ccc(-n5cccc5)cc4)c3)cc2)c1,ClCCl,388.7195122
c1ccncc1,CC1CCCCC1,252.0
c1ccncc1,Cc1ccccc1,296.0
c1ccncc1,ClC(Cl)Cl,253.0
c1ccncc1,O,253.0
c1ccsc1,ClCCl,230.0
c1cn[n-]c1,O,700.0
c1cnc(-c2c3ccccc3c(-c3cncnc3)c3ccccc23)nc1,CCO,391.0
c1cnc(-c2c3ccccc3c(-c3cncnc3)c3ccccc23)nc1,ClCCl,394.0
c1cnc2c(c1)c1nc(-c3ccc(-c4nc5c6cccnc6c6ncccc6c5[nH]4)cc3)[nH]c1c1cccnc12,CS(C)=O,398.0
c1cnc2c(c1)ccc1cc(-c3ccsc3)cnc12,ClCCl,426.0
c1cnc2c(c1)ccc1cccnc12,CCOC(C)=O,440.0
c1cncc(-c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)c1,C1CCCCC1,308.0
c1cnccn1,C1CCOC1,530.0
c1conn1,ClC(Cl)Cl,294.0
c1csc(-c2c3ccc(=[N+]4CCCCC4)cc-3oc3cc(N4CCCCC4)ccc23)c1,CCO,581.0
c1csc(-c2c3ccc(=[N+]4CCCCC4)cc-3oc3cc(N4CCCCC4)ccc23)c1,ClCCl,582.0
c1csc(-c2cc(-c3cccs3)c3ccc4c(-c5cccs5)cc(-c5cccs5)c5ccc2c3c54)c1,C1CCCCC1,416.0
c1csc(-c2cc(N=Nc3nccs3)c(N3CCCCC3)s2)c1,C1COCCO1,531.0
c1csc(-c2cc3ccc4cc(-c5cccs5)nc5c6ccccc6c(n2)c3c45)c1,Cc1ccccc1,346.0
c1csc(-c2cc3cccc4c5nc(-c6cccs6)cc6cccc(c(n2)c34)c65)c1,Cc1ccccc1,315.0
c1csc(-c2ccc(-c3ccc(-c4ccc(-c5cccs5)s4)s3)s2)c1,CC#N,413.0
c1csc(-c2ccc(-c3ccc(-c4cccs4)s3)s2)c1,CCCCCCCCCCCCCC,391.0
c1csc(-c2ccc(-c3ccc(-c4cccs4)s3)s2)c1,ClCCl,393.0
c1csc(-c2ccc(-c3cccs3)c3nsnc23)c1,ClC(Cl)Cl,445.0
c1csc(-c2ccc(-c3cccs3)s2)c1,CC#N,351.0
c1csc(-c2ccc(-c3cccs3)s2)c1,ClCCl,355.0
c1csc(-c2ccc(N=Nc3nc4ccccc4s3)n2-c2cccc3ccccc23)c1,CS(C)=O,528.0
c1csc(-c2ccc(N=Nc3nccs3)s2)c1,C1COCCO1,497.0
c1csc(-c2ccc(N=Nc3nncs3)s2)c1,CS(C)=O,494.0
c1csc(-c2ccc3c4ccc(-c5cccs5)cc4n(-c4cccs4)c3c2)c1,ClCCl,352.0
c1csc(-c2ccc3ccc4c(-c5cccs5)ccc5ccc2c3c54)c1,ClC(Cl)Cl,371.0
c1csc(-c2ccc3ccc4cccc5ccc2c3c45)c1,ClC(Cl)Cl,347.0
c1csc(-c2cccs2)c1,ClCCl,304.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,C1CCCCC1,461.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,CC(C)=O,461.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,CCCCCC,458.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,CCCO,466.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,CCO,460.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,CCOCC,462.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,CO,460.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,Cc1ccccc1,465.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,ClC(Cl)(Cl)Cl,465.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,ClC(Cl)Cl,464.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,Nc1ccccc1,474.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,O=[N+]([O-])c1ccccc1,476.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,OCC(O)CO,471.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,OCc1ccccc1,473.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,c1ccc2ncccc2c1,477.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,c1ccccc1,465.0
c1csc(-c2cnc(-c3cccs3)c3nonc23)c1,c1ccncc1,472.0
c1csc(-c2nc3c4ccccc4c4cccc2n43)c1,CO,469.0
c1csc(-c2nc3ccccc3c3cc4ccccn4c23)c1,CS(C)=O,403.0
c1csc(-c2nnc3ccccn23)c1,ClCCl,301.0
c1csc(-c2nnnnc2-c2cccs2)c1,ClCCl,923.0
c1csc(-n2c3ccccc3c3ccccc32)c1,ClCCl,333.0