phenyl 2,2-dimethyl-3-oxidanylidene-pentanoate

Systemtic Name: phenyl 2,2-dimethyl-3-oxidanylidene-pentanoate Openeye Name: phenyl 2,2-dimethyl-3-oxo-pentanoate CAS Name: 2,2-dimethyl-3-oxopentanoic acid phenyl ester IUPAC Name: phenyl 2,2-dimethyl-3-oxopentanoate Traditional Name: 3-keto-2,2-dimethyl-valeric acid phenyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)(C)C(=O)OC1=CC=CC=C1

Isomeric SMILES

CCC(=O)C(C)(C)C(=O)OC1=CC=CC=C1

InChI

InChI=1S/C13H16O3/c1-4-11(14)13(2,3)12(15)16-10-8-6-5-7-9-10/h5-9H,4H2,1-3H3