methyl 3,3-dimethyl-4-oxidanylidene-4-(4-phenylmethoxyphenyl)butanoate

Systemtic Name: methyl 3,3-dimethyl-4-oxidanylidene-4-(4-phenylmethoxyphenyl)butanoate Openeye Name: methyl 4-(4-benzyloxyphenyl)-3,3-dimethyl-4-oxo-butanoate CAS Name: 3,3-dimethyl-4-oxo-4-(4-phenylmethoxyphenyl)butanoic acid methyl ester IUPAC Name: methyl 3,3-dimethyl-4-oxo-4-(4-phenylmethoxyphenyl)butanoate Traditional Name: 4-(4-benzoxyphenyl)-4-keto-3,3-dimethyl-butyric acid methyl ester Formula: C20H22O4 MolecularWeight: 326.38628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)OC)C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(CC(=O)OC)C(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22O4/c1-20(2,13-18(21)23-3)19(22)16-9-11-17(12-10-16)24-14-15-7-5-4-6-8-15/h4-12H,13-14H2,1-3H3