[(4-methylphenyl)carbonylamino] 3-oxidanylidenebutanoate

Systemtic Name: [(4-methylphenyl)carbonylamino] 3-oxidanylidenebutanoate Openeye Name: [(4-methylbenzoyl)amino] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [[(4-methylphenyl)-oxomethyl]amino] ester IUPAC Name: [(4-methylbenzoyl)amino] 3-oxobutanoate Traditional Name: 3-ketobutyric acid (p-toluoylamino) ester Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NOC(=O)CC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NOC(=O)CC(=O)C

InChI

InChI=1S/C12H13NO4/c1-8-3-5-10(6-4-8)12(16)13-17-11(15)7-9(2)14/h3-6H,7H2,1-2H3,(H,13,16)