(5-methyl-6-oxidanyl-3-oxidanylidene-1-phenyl-hexan-2-yl) benzoate

Systemtic Name: (5-methyl-6-oxidanyl-3-oxidanylidene-1-phenyl-hexan-2-yl) benzoate Openeye Name: (1-benzyl-5-hydroxy-4-methyl-2-oxo-pentyl) benzoate CAS Name: benzoic acid (6-hydroxy-5-methyl-3-oxo-1-phenylhexan-2-yl) ester IUPAC Name: (6-hydroxy-5-methyl-3-oxo-1-phenylhexan-2-yl) benzoate Traditional Name: benzoic acid (1-benzyl-5-hydroxy-2-keto-4-methyl-pentyl) ester Formula: C20H22O4 MolecularWeight: 326.38628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C(CC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)CO

Isomeric SMILES

CC(CC(=O)C(CC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)CO

InChI

InChI=1S/C20H22O4/c1-15(14-21)12-18(22)19(13-16-8-4-2-5-9-16)24-20(23)17-10-6-3-7-11-17/h2-11,15,19,21H,12-14H2,1H3