(phenylmethyl) 4-chloranyl-3,3-dimethyl-4-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 4-chloranyl-3,3-dimethyl-4-oxidanylidene-butanoate Openeye Name: benzyl 4-chloro-3,3-dimethyl-4-oxo-butanoate CAS Name: 4-chloro-3,3-dimethyl-4-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-chloro-3,3-dimethyl-4-oxobutanoate Traditional Name: 4-chloro-4-keto-3,3-dimethyl-butyric acid benzyl ester Formula: C13H15ClO3 MolecularWeight: 254.7094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15ClO3/c1-13(2,12(14)16)8-11(15)17-9-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3