Compound Name

SMILES String

COc1c(O)c(C(C)=O)c(OCc2ccc(Cl)cc2)c2ccoc12

CC(=O)c1c(O)c(OCc2ccccc2)c2occc2c1OCc1ccccc1

COc1c(C(C)=O)c(O)c(OCc2ccc(Br)cc2)c2occc12

Cc1ccc(cc1)C(c1ccc([nH]1)C(=O)NCCN)(c1ccc([nH]1)C(=O)NCCN)c1ccc(C)cc1

CC1(C)OCC(Br)(CO1)[N+]([O-])=O

[O-][N+](=O)C1(Br)COC(OC1)c1ccccc1 |(.89,-23.14,;-.45,-22.38,;-.46,-20.84,;-1.78,-23.16,;-3.12,-22.39,;-.45,-23.94,;-.45,-25.47,;-1.78,-26.24,;-3.11,-25.48,;-3.11,-23.93,;-1.77,-27.77,;-3.1,-28.54,;-3.1,-30.09,;-1.76,-30.86,;-.43,-30.09,;-.43,-28.54,)|

Cc1[nH]c(cc1Cl)C(=O)NC\C=C\c1c[nH]c(N)n1

Cc1[nH]c(cc1Br)C(=O)NC\C=C\c1c[nH]c(N)n1

Cc1[nH]c(C(=O)NC\C=C\c2c[nH]c(N)n2)c(Br)c1Br

Nc1nc(\C=C\CNC(=O)c2cc(Cl)c(Cl)[nH]2)c[nH]1

Nc1nc(\C=C\CNC(=O)c2cc3cc(F)ccc3[nH]2)c[nH]1

O=c1ccc2c(OCCCCOc3ccccc3)c3ccoc3cc2o1

Nc1ncc(C=CCNC(=O)c2cc(Br)c(Br)[nH]2)[nH]1 |w:6.6|

Nc1nc(\C=C\CNC(=O)c2cc(Br)c[nH]2)c[nH]1

Nc1nc(\C=C\CNC(=O)c2cc3cc(Cl)ccc3[nH]2)c[nH]1

Nc1ncc(\C=C\CNC(=O)c2ccc[nH]2)[nH]1

Nc1nc(\C=C\CNC(=O)c2cc3ccccc3[nH]2)c[nH]1