ethyl 2-(3-methylphenyl)carbonyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-(3-methylphenyl)carbonyl-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(3-methylbenzoyl)-3-oxo-butanoate CAS Name: 2-[(3-methylphenyl)-oxomethyl]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(3-methylbenzoyl)-3-oxobutanoate Traditional Name: 3-keto-2-m-toluoyl-butyric acid ethyl ester Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)C(=O)C1=CC(=CC=C1)C

Isomeric SMILES

CCOC(=O)C(C(=O)C)C(=O)C1=CC(=CC=C1)C

InChI

InChI=1S/C14H16O4/c1-4-18-14(17)12(10(3)15)13(16)11-7-5-6-9(2)8-11/h5-8,12H,4H2,1-3H3