4-(2-acetamidophenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2-acetamidophenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2-acetamidophenyl)-4-oxo-butanoic acid CAS Name: 4-(2-acetamidophenyl)-4-oxobutanoic acid IUPAC Name: 4-(2-acetamidophenyl)-4-oxobutanoic acid Traditional Name: 4-(2-acetamidophenyl)-4-keto-butyric acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC=C1C(=O)CCC(=O)O

Isomeric SMILES

CC(=O)NC1=CC=CC=C1C(=O)CCC(=O)O

InChI

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