(phenylmethyl) 5-chloranyl-4,4-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 5-chloranyl-4,4-dimethyl-5-oxidanylidene-pentanoate Openeye Name: benzyl 5-chloro-4,4-dimethyl-5-oxo-pentanoate CAS Name: 5-chloro-4,4-dimethyl-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-chloro-4,4-dimethyl-5-oxopentanoate Traditional Name: 5-chloro-5-keto-4,4-dimethyl-valeric acid benzyl ester Formula: C14H17ClO3 MolecularWeight: 268.73598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)OCC1=CC=CC=C1)C(=O)Cl

Isomeric SMILES

CC(C)(CCC(=O)OCC1=CC=CC=C1)C(=O)Cl

InChI

InChI=1S/C14H17ClO3/c1-14(2,13(15)17)9-8-12(16)18-10-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3