(4-chlorophenyl)methyl 4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: (4-chlorophenyl)methyl 4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoate Openeye Name: (4-chlorophenyl)methyl 4-(3-nitroanilino)-4-oxo-butanoate CAS Name: 4-(3-nitroanilino)-4-oxobutanoic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 4-(3-nitroanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(3-nitroanilino)butyric acid (4-chlorobenzyl) ester Formula: C17H15ClN2O5 MolecularWeight: 362.7644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCC(=O)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCC(=O)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H15ClN2O5/c18-13-6-4-12(5-7-13)11-25-17(22)9-8-16(21)19-14-2-1-3-15(10-14)20(23)24/h1-7,10H,8-9,11H2,(H,19,21)