methyl 5,5-dimethyl-4-oxidanylidene-2-(2-phenylethanoyl)hexanoate

Systemtic Name: methyl 5,5-dimethyl-4-oxidanylidene-2-(2-phenylethanoyl)hexanoate Openeye Name: methyl 5,5-dimethyl-4-oxo-2-(2-phenylacetyl)hexanoate CAS Name: 5,5-dimethyl-4-oxo-2-(1-oxo-2-phenylethyl)hexanoic acid methyl ester IUPAC Name: methyl 5,5-dimethyl-4-oxo-2-(2-phenylacetyl)hexanoate Traditional Name: 4-keto-5,5-dimethyl-2-(2-phenylacetyl)hexanoic acid methyl ester Formula: C17H22O4 MolecularWeight: 290.35418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC(C(=O)CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)CC(C(=O)CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H22O4/c1-17(2,3)15(19)11-13(16(20)21-4)14(18)10-12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3