4-(3-acetamidophenyl)-4-oxidanylidene-butanoate

Systemtic Name: 4-(3-acetamidophenyl)-4-oxidanylidene-butanoate Openeye Name: 4-(3-acetamidophenyl)-4-oxo-butanoate CAS Name: 4-(3-acetamidophenyl)-4-oxobutanoate IUPAC Name: 4-(3-acetamidophenyl)-4-oxobutanoate Traditional Name: 4-(3-acetamidophenyl)-4-keto-butyrate Formula: C12H12NO4- MolecularWeight: 234.22798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C(=O)CCC(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H13NO4/c1-8(14)13-10-4-2-3-9(7-10)11(15)5-6-12(16)17/h2-4,7H,5-6H2,1H3,(H,13,14)(H,16,17)/p-1