methyl 3-(2-ethanoyl-3-oxidanylidene-butyl)benzoate

Systemtic Name: methyl 3-(2-ethanoyl-3-oxidanylidene-butyl)benzoate Openeye Name: methyl 3-(2-acetyl-3-oxo-butyl)benzoate CAS Name: 3-(2-acetyl-3-oxobutyl)benzoic acid methyl ester IUPAC Name: methyl 3-(2-acetyl-3-oxobutyl)benzoate Traditional Name: 3-(2-acetyl-3-keto-butyl)benzoic acid methyl ester Formula: C14H16O4 MolecularWeight: 248.27444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O4/c1-9(15)13(10(2)16)8-11-5-4-6-12(7-11)14(17)18-3/h4-7,13H,8H2,1-3H3