methyl 2-(4-chlorophenyl)carbonyl-5,5-dimethyl-4-oxidanylidene-hexanoate

Systemtic Name: methyl 2-(4-chlorophenyl)carbonyl-5,5-dimethyl-4-oxidanylidene-hexanoate Openeye Name: methyl 2-(4-chlorobenzoyl)-5,5-dimethyl-4-oxo-hexanoate CAS Name: 2-[(4-chlorophenyl)-oxomethyl]-5,5-dimethyl-4-oxohexanoic acid methyl ester IUPAC Name: methyl 2-(4-chlorobenzoyl)-5,5-dimethyl-4-oxohexanoate Traditional Name: 2-(4-chlorobenzoyl)-4-keto-5,5-dimethyl-hexanoic acid methyl ester Formula: C16H19ClO4 MolecularWeight: 310.77266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClO4/c1-16(2,3)13(18)9-12(15(20)21-4)14(19)10-5-7-11(17)8-6-10/h5-8,12H,9H2,1-4H3