methyl 4,4-dimethyl-3-oxidanylidene-2-phenethyl-pentanoate

Systemtic Name: methyl 4,4-dimethyl-3-oxidanylidene-2-phenethyl-pentanoate Openeye Name: methyl 4,4-dimethyl-3-oxo-2-phenethyl-pentanoate CAS Name: 4,4-dimethyl-3-oxo-2-phenethylpentanoic acid methyl ester IUPAC Name: methyl 4,4-dimethyl-3-oxo-2-phenethylpentanoate Traditional Name: 3-keto-4,4-dimethyl-2-phenethyl-valeric acid methyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(CCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)C(CCC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C16H22O3/c1-16(2,3)14(17)13(15(18)19-4)11-10-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3