2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[2-(4-nitrophenyl)ethyl]-1-piperazinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[2-(4-nitrophenyl)ethyl]piperazino]-1H-benzimidazole-4-carboxamide Formula: C20H22N6O3 MolecularWeight: 394.42708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=C(C=CC=C4N3)C(=O)N

Isomeric SMILES

C1CN(CCN1CCC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=C(C=CC=C4N3)C(=O)N

InChI

InChI=1S/C20H22N6O3/c21-19(27)16-2-1-3-17-18(16)23-20(22-17)25-12-10-24(11-13-25)9-8-14-4-6-15(7-5-14)26(28)29/h1-7H,8-13H2,(H2,21,27)(H,22,23)