[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-[(3-ethanoylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 4-[(3-ethanoylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 4-(3-acetylanilino)-4-oxo-butanoate CAS Name: 4-(3-acetylanilino)-4-oxobutanoic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 4-(3-acetylanilino)-4-oxobutanoate Traditional Name: 4-(3-acetylanilino)-4-keto-butyric acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C20H19N3O7 MolecularWeight: 413.38076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CCC(=O)OCC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O7/c1-13(24)14-4-2-5-15(10-14)21-18(25)8-9-20(27)30-12-19(26)22-16-6-3-7-17(11-16)23(28)29/h2-7,10-11H,8-9,12H2,1H3,(H,21,25)(H,22,26)