N-(3-cyanophenyl)-4-[(4-methylphenyl)amino]-3-nitro-benzamide

Systemtic Name: N-(3-cyanophenyl)-4-[(4-methylphenyl)amino]-3-nitro-benzamide Openeye Name: N-(3-cyanophenyl)-4-(4-methylanilino)-3-nitro-benzamide CAS Name: N-(3-cyanophenyl)-4-(4-methylanilino)-3-nitrobenzamide IUPAC Name: N-(3-cyanophenyl)-4-(4-methylanilino)-3-nitrobenzamide Traditional Name: N-(3-cyanophenyl)-3-nitro-4-(p-toluidino)benzamide Formula: C21H16N4O3 MolecularWeight: 372.37674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O3/c1-14-5-8-17(9-6-14)23-19-10-7-16(12-20(19)25(27)28)21(26)24-18-4-2-3-15(11-18)13-22/h2-12,23H,1H3,(H,24,26)