methyl 4-methyl-2-oxidanyl-3-oxidanylidene-2-phenyl-pentanoate

Systemtic Name: methyl 4-methyl-2-oxidanyl-3-oxidanylidene-2-phenyl-pentanoate Openeye Name: methyl 2-hydroxy-4-methyl-3-oxo-2-phenyl-pentanoate CAS Name: 2-hydroxy-4-methyl-3-oxo-2-phenylpentanoic acid methyl ester IUPAC Name: methyl 2-hydroxy-4-methyl-3-oxo-2-phenylpentanoate Traditional Name: 2-hydroxy-3-keto-4-methyl-2-phenyl-valeric acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(C1=CC=CC=C1)(C(=O)OC)O

Isomeric SMILES

CC(C)C(=O)C(C1=CC=CC=C1)(C(=O)OC)O

InChI

InChI=1S/C13H16O4/c1-9(2)11(14)13(16,12(15)17-3)10-7-5-4-6-8-10/h4-9,16H,1-3H3