5-[(6-oxidanyl-6-oxidanylidene-hexan-2-yl)disulfanyl]hexanoic acid

Systemtic Name: 5-[(6-oxidanyl-6-oxidanylidene-hexan-2-yl)disulfanyl]hexanoic acid Openeye Name: 5-[(5-hydroxy-1-methyl-5-oxo-pentyl)disulfanyl]hexanoic acid CAS Name: 5-[(6-hydroxy-6-oxohexan-2-yl)disulfanyl]hexanoic acid IUPAC Name: 5-[(6-hydroxy-6-oxohexan-2-yl)disulfanyl]hexanoic acid Traditional Name: 5-[(5-hydroxy-5-keto-1-methyl-pentyl)disulfanyl]hexanoic acid Formula: C12H22O4S2 MolecularWeight: 294.43068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC(=O)O)SSC(C)CCCC(=O)O

Isomeric SMILES

CC(CCCC(=O)O)SSC(C)CCCC(=O)O

InChI

InChI=1S/C12H22O4S2/c1-9(5-3-7-11(13)14)17-18-10(2)6-4-8-12(15)16/h9-10H,3-8H2,1-2H3,(H,13,14)(H,15,16)