4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-nitrophenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-nitroanilino)-4-oxo-butanoic acid CAS Name: 4-(3-nitroanilino)-4-oxobutanoic acid IUPAC Name: 4-(3-nitroanilino)-4-oxobutanoic acid Traditional Name: 4-keto-4-(3-nitroanilino)butyric acid Formula: C10H10N2O5 MolecularWeight: 238.1968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O5/c13-9(4-5-10(14)15)11-7-2-1-3-8(6-7)12(16)17/h1-3,6H,4-5H2,(H,11,13)(H,14,15)