(phenylmethyl) 5-chloranyl-2,4-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 5-chloranyl-2,4-dimethyl-5-oxidanylidene-pentanoate Openeye Name: benzyl 5-chloro-2,4-dimethyl-5-oxo-pentanoate CAS Name: 5-chloro-2,4-dimethyl-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-chloro-2,4-dimethyl-5-oxopentanoate Traditional Name: 5-chloro-5-keto-2,4-dimethyl-valeric acid benzyl ester Formula: C14H17ClO3 MolecularWeight: 268.73598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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