N-(4-methylphenyl)-5-nitro-2-[(phenylmethyl)amino]benzamide

Systemtic Name: N-(4-methylphenyl)-5-nitro-2-[(phenylmethyl)amino]benzamide Openeye Name: 2-(benzylamino)-5-nitro-N-(p-tolyl)benzamide CAS Name: N-(4-methylphenyl)-5-nitro-2-[(phenylmethyl)amino]benzamide IUPAC Name: 2-(benzylamino)-N-(4-methylphenyl)-5-nitrobenzamide Traditional Name: 2-(benzylamino)-5-nitro-N-(p-tolyl)benzamide Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3

InChI

InChI=1S/C21H19N3O3/c1-15-7-9-17(10-8-15)23-21(25)19-13-18(24(26)27)11-12-20(19)22-14-16-5-3-2-4-6-16/h2-13,22H,14H2,1H3,(H,23,25)