(phenylmethyl) 4-methyl-2-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 4-methyl-2-oxidanylidene-pentanoate Openeye Name: benzyl 4-methyl-2-oxo-pentanoate CAS Name: 4-methyl-2-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methyl-2-oxopentanoate Traditional Name: 2-keto-4-methyl-valeric acid benzyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O3/c1-10(2)8-12(14)13(15)16-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3