4-[(4-ethoxy-2-nitro-phenyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-ethoxy-2-nitro-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-ethoxy-2-nitro-anilino)-4-oxo-butanoic acid CAS Name: 4-(4-ethoxy-2-nitroanilino)-4-oxobutanoic acid IUPAC Name: 4-(4-ethoxy-2-nitroanilino)-4-oxobutanoic acid Traditional Name: 4-(4-ethoxy-2-nitro-anilino)-4-keto-butyric acid Formula: C12H14N2O6 MolecularWeight: 282.24936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)CCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)CCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O6/c1-2-20-8-3-4-9(10(7-8)14(18)19)13-11(15)5-6-12(16)17/h3-4,7H,2,5-6H2,1H3,(H,13,15)(H,16,17)