8-(6,6-dimethyl-8-oxidanyl-octyl)sulfanyl-3,3-dimethyl-octanoic acid

Systemtic Name: 8-(6,6-dimethyl-8-oxidanyl-octyl)sulfanyl-3,3-dimethyl-octanoic acid Openeye Name: 8-(8-hydroxy-6,6-dimethyl-octyl)sulfanyl-3,3-dimethyl-octanoic acid CAS Name: 8-[(8-hydroxy-6,6-dimethyloctyl)thio]-3,3-dimethyloctanoic acid IUPAC Name: 8-(8-hydroxy-6,6-dimethyloctyl)sulfanyl-3,3-dimethyloctanoic acid Traditional Name: 8-[(8-hydroxy-6,6-dimethyl-octyl)thio]-3,3-dimethyl-caprylic acid Formula: C20H40O3S MolecularWeight: 360.5948

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCSCCCCCC(C)(C)CC(=O)O)CCO

Isomeric SMILES

CC(C)(CCCCCSCCCCCC(C)(C)CC(=O)O)CCO

InChI

InChI=1S/C20H40O3S/c1-19(2,13-14-21)11-7-5-9-15-24-16-10-6-8-12-20(3,4)17-18(22)23/h21H,5-17H2,1-4H3,(H,22,23)