(diphenylmethyl) 4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (diphenylmethyl) 4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: benzhydryl 4-(3-nitroanilino)-4-oxo-butanoate CAS Name: 4-(3-nitroanilino)-4-oxobutanoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 4-(3-nitroanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(3-nitroanilino)butyric acid benzhydryl ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC(=O)CCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O5/c26-21(24-19-12-7-13-20(16-19)25(28)29)14-15-22(27)30-23(17-8-3-1-4-9-17)18-10-5-2-6-11-18/h1-13,16,23H,14-15H2,(H,24,26)