1-(4-azanyl-4-oxidanylidene-butyl)-2-(2-chloranyl-3,4-dimethoxy-6-nitro-phenyl)-N-(4-methylphenyl)benzimidazole-5-carboxamide

Systemtic Name: 1-(4-azanyl-4-oxidanylidene-butyl)-2-(2-chloranyl-3,4-dimethoxy-6-nitro-phenyl)-N-(4-methylphenyl)benzimidazole-5-carboxamide Openeye Name: 1-(4-amino-4-oxo-butyl)-2-(2-chloro-3,4-dimethoxy-6-nitro-phenyl)-N-(p-tolyl)benzimidazole-5-carboxamide CAS Name: 1-(4-amino-4-oxobutyl)-2-(2-chloro-3,4-dimethoxy-6-nitrophenyl)-N-(4-methylphenyl)-5-benzimidazolecarboxamide IUPAC Name: 1-(4-amino-4-oxobutyl)-2-(2-chloro-3,4-dimethoxy-6-nitrophenyl)-N-(4-methylphenyl)benzimidazole-5-carboxamide Traditional Name: 1-(4-amino-4-keto-butyl)-2-(2-chloro-3,4-dimethoxy-6-nitro-phenyl)-N-(p-tolyl)benzimidazole-5-carboxamide Formula: C27H26ClN5O6 MolecularWeight: 551.97824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=C(C(=C(C=C4[N+](=O)[O-])OC)OC)Cl)CCCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=C(C(=C(C=C4[N+](=O)[O-])OC)OC)Cl)CCCC(=O)N

InChI

InChI=1S/C27H26ClN5O6/c1-15-6-9-17(10-7-15)30-27(35)16-8-11-19-18(13-16)31-26(32(19)12-4-5-22(29)34)23-20(33(36)37)14-21(38-2)25(39-3)24(23)28/h6-11,13-14H,4-5,12H2,1-3H3,(H2,29,34)(H,30,35)