(phenylmethyl) 4,4-dimethyl-3-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 4,4-dimethyl-3-oxidanylidene-pentanoate Openeye Name: benzyl 4,4-dimethyl-3-oxo-pentanoate CAS Name: 4,4-dimethyl-3-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4,4-dimethyl-3-oxopentanoate Traditional Name: 3-keto-4,4-dimethyl-valeric acid benzyl ester Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O3/c1-14(2,3)12(15)9-13(16)17-10-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3