3-(1H-benzimidazol-2-yl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide

Systemtic Name: 3-(1H-benzimidazol-2-yl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide Openeye Name: 3-(1H-benzimidazol-2-yl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propanamide CAS Name: 3-(1H-benzimidazol-2-yl)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]propanamide IUPAC Name: 3-(1H-benzimidazol-2-yl)-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]propanamide Traditional Name: 3-(1H-benzimidazol-2-yl)-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]propionamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=NC3=CC=CC=C3N2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)CCC2=NC3=CC=CC=C3N2)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22N4O5/c1-28-17-11-13(16(24(26)27)12-18(17)29-2)9-10-21-20(25)8-7-19-22-14-5-3-4-6-15(14)23-19/h3-6,11-12H,7-10H2,1-2H3,(H,21,25)(H,22,23)