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

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (2-anilino-2-oxo-ethyl) 4-(3-nitroanilino)-4-oxo-butanoate CAS Name: 4-(3-nitroanilino)-4-oxobutanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 4-(3-nitroanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(3-nitroanilino)butyric acid (2-anilino-2-keto-ethyl) ester Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O6/c22-16(20-14-7-4-8-15(11-14)21(25)26)9-10-18(24)27-12-17(23)19-13-5-2-1-3-6-13/h1-8,11H,9-10,12H2,(H,19,23)(H,20,22)