methyl 2-[1-(3-chlorophenyl)ethyl]-3-oxidanylidene-butanoate

Systemtic Name: methyl 2-[1-(3-chlorophenyl)ethyl]-3-oxidanylidene-butanoate Openeye Name: methyl 2-acetyl-3-(3-chlorophenyl)butanoate CAS Name: 2-acetyl-3-(3-chlorophenyl)butanoic acid methyl ester IUPAC Name: methyl 2-acetyl-3-(3-chlorophenyl)butanoate Traditional Name: 2-acetyl-3-(3-chlorophenyl)butyric acid methyl ester Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClO3/c1-8(10-5-4-6-11(14)7-10)12(9(2)15)13(16)17-3/h4-8,12H,1-3H3