4-[3-[(3,4-dimethoxyphenyl)methyl]-5-nitro-2-oxidanylidene-benzimidazol-1-yl]cyclohexane-1-carboxamide

Systemtic Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-5-nitro-2-oxidanylidene-benzimidazol-1-yl]cyclohexane-1-carboxamide Openeye Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-5-nitro-2-oxo-benzimidazol-1-yl]cyclohexanecarboxamide CAS Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-5-nitro-2-oxo-1-benzimidazolyl]-1-cyclohexanecarboxamide IUPAC Name: 4-[3-[(3,4-dimethoxyphenyl)methyl]-5-nitro-2-oxobenzimidazol-1-yl]cyclohexane-1-carboxamide Traditional Name: 4-(2-keto-5-nitro-3-veratryl-benzimidazol-1-yl)cyclohexanecarboxamide Formula: C23H26N4O6 MolecularWeight: 454.47574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])N(C2=O)C4CCC(CC4)C(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C3=C(C=CC(=C3)[N+](=O)[O-])N(C2=O)C4CCC(CC4)C(=O)N)OC

InChI

InChI=1S/C23H26N4O6/c1-32-20-10-3-14(11-21(20)33-2)13-25-19-12-17(27(30)31)8-9-18(19)26(23(25)29)16-6-4-15(5-7-16)22(24)28/h3,8-12,15-16H,4-7,13H2,1-2H3,(H2,24,28)