3-(6-nitro-1-oxidanyl-benzimidazol-2-yl)-N-(phenylmethyl)aniline

Systemtic Name: 3-(6-nitro-1-oxidanyl-benzimidazol-2-yl)-N-(phenylmethyl)aniline Openeye Name: N-benzyl-3-(1-hydroxy-6-nitro-benzimidazol-2-yl)aniline CAS Name: 3-(1-hydroxy-6-nitro-2-benzimidazolyl)-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-3-(1-hydroxy-6-nitrobenzimidazol-2-yl)aniline Traditional Name: benzyl-[3-(1-hydroxy-6-nitro-benzimidazol-2-yl)phenyl]amine Formula: C20H16N4O3 MolecularWeight: 360.36604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=CC=CC(=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CNC2=CC=CC(=C2)C3=NC4=C(N3O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O3/c25-23-19-12-17(24(26)27)9-10-18(19)22-20(23)15-7-4-8-16(11-15)21-13-14-5-2-1-3-6-14/h1-12,21,25H,13H2