6-(4,4-dimethyl-6-oxidanyl-6-oxidanylidene-hexyl)sulfanyl-3,3-dimethyl-hexanoic acid

Systemtic Name: 6-(4,4-dimethyl-6-oxidanyl-6-oxidanylidene-hexyl)sulfanyl-3,3-dimethyl-hexanoic acid Openeye Name: 6-(6-hydroxy-4,4-dimethyl-6-oxo-hexyl)sulfanyl-3,3-dimethyl-hexanoic acid CAS Name: 6-[(6-hydroxy-4,4-dimethyl-6-oxohexyl)thio]-3,3-dimethylhexanoic acid IUPAC Name: 6-(6-hydroxy-4,4-dimethyl-6-oxohexyl)sulfanyl-3,3-dimethylhexanoic acid Traditional Name: 6-[(6-hydroxy-6-keto-4,4-dimethyl-hexyl)thio]-3,3-dimethyl-hexanoic acid Formula: C16H30O4S MolecularWeight: 318.472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCSCCCC(C)(C)CC(=O)O)CC(=O)O

Isomeric SMILES

CC(C)(CCCSCCCC(C)(C)CC(=O)O)CC(=O)O

InChI

InChI=1S/C16H30O4S/c1-15(2,11-13(17)18)7-5-9-21-10-6-8-16(3,4)12-14(19)20/h5-12H2,1-4H3,(H,17,18)(H,19,20)