[1-(4-nitrophenyl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] benzoate

Systemtic Name: [1-(4-nitrophenyl)-2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] benzoate Openeye Name: [2-(benzylamino)-1-(4-nitrophenyl)-2-oxo-ethyl] benzoate CAS Name: benzoic acid [1-(4-nitrophenyl)-2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-1-(4-nitrophenyl)-2-oxoethyl] benzoate Traditional Name: benzoic acid [2-(benzylamino)-2-keto-1-(4-nitrophenyl)ethyl] ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O5/c25-21(23-15-16-7-3-1-4-8-16)20(17-11-13-19(14-12-17)24(27)28)29-22(26)18-9-5-2-6-10-18/h1-14,20H,15H2,(H,23,25)