(3R)-4-methyl-3-(4-methylphenyl)-3-oxidanyl-pentanoate

Systemtic Name: (3R)-4-methyl-3-(4-methylphenyl)-3-oxidanyl-pentanoate Openeye Name: (3R)-3-hydroxy-4-methyl-3-(p-tolyl)pentanoate CAS Name: (3R)-3-hydroxy-4-methyl-3-(4-methylphenyl)pentanoate IUPAC Name: (3R)-3-hydroxy-4-methyl-3-(4-methylphenyl)pentanoate Traditional Name: (3R)-3-hydroxy-4-methyl-3-(p-tolyl)valerate Formula: C13H17O3- MolecularWeight: 221.27228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)[O-])(C(C)C)O

Isomeric SMILES

CC1=CC=C(C=C1)[C@@](CC(=O)[O-])(C(C)C)O

InChI

InChI=1S/C13H18O3/c1-9(2)13(16,8-12(14)15)11-6-4-10(3)5-7-11/h4-7,9,16H,8H2,1-3H3,(H,14,15)/p-1/t13-/m1/s1