2-[6,8-bis(sulfanyl)octanoylamino]hexanoic acid

Systemtic Name: 2-[6,8-bis(sulfanyl)octanoylamino]hexanoic acid Openeye Name: 2-[6,8-bis(sulfanyl)octanoylamino]hexanoic acid CAS Name: 2-[(6,8-dimercapto-1-oxooctyl)amino]hexanoic acid IUPAC Name: 2-[6,8-bis(sulfanyl)octanoylamino]hexanoic acid Traditional Name: 2-(6,8-dimercaptooctanoylamino)hexanoic acid Formula: C14H27NO3S2 MolecularWeight: 321.49908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)CCCCC(CCS)S

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)CCCCC(CCS)S

InChI

InChI=1S/C14H27NO3S2/c1-2-3-7-12(14(17)18)15-13(16)8-5-4-6-11(20)9-10-19/h11-12,19-20H,2-10H2,1H3,(H,15,16)(H,17,18)