(phenylmethyl) 3,3-dimethyl-2-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) 3,3-dimethyl-2-oxidanylidene-butanoate Openeye Name: benzyl 3,3-dimethyl-2-oxo-butanoate CAS Name: 3,3-dimethyl-2-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3,3-dimethyl-2-oxobutanoate Traditional Name: 2-keto-3,3-dimethyl-butyric acid benzyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3/c1-13(2,3)11(14)12(15)16-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3