methyl 4-methyl-2-oxidanylidene-4-phenyl-pentanoate

Systemtic Name: methyl 4-methyl-2-oxidanylidene-4-phenyl-pentanoate Openeye Name: methyl 4-methyl-2-oxo-4-phenyl-pentanoate CAS Name: 4-methyl-2-oxo-4-phenylpentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-oxo-4-phenylpentanoate Traditional Name: 2-keto-4-methyl-4-phenyl-valeric acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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