(phenylmethyl) 4,4-dimethyl-2-oxidanyl-3-oxidanylidene-pentanoate

Systemtic Name: (phenylmethyl) 4,4-dimethyl-2-oxidanyl-3-oxidanylidene-pentanoate Openeye Name: benzyl 2-hydroxy-4,4-dimethyl-3-oxo-pentanoate CAS Name: 2-hydroxy-4,4-dimethyl-3-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-hydroxy-4,4-dimethyl-3-oxopentanoate Traditional Name: 2-hydroxy-3-keto-4,4-dimethyl-valeric acid benzyl ester Formula: C14H18O4 MolecularWeight: 250.29032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O4/c1-14(2,3)12(16)11(15)13(17)18-9-10-7-5-4-6-8-10/h4-8,11,15H,9H2,1-3H3