2-[6,8-bis(sulfanyl)octanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[6,8-bis(sulfanyl)octanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[6,8-bis(sulfanyl)octanoylamino]-3-hydroxy-butanoic acid CAS Name: 2-[(6,8-dimercapto-1-oxooctyl)amino]-3-hydroxybutanoic acid IUPAC Name: 2-[6,8-bis(sulfanyl)octanoylamino]-3-hydroxybutanoic acid Traditional Name: 2-(6,8-dimercaptooctanoylamino)-3-hydroxy-butyric acid Formula: C12H23NO4S2 MolecularWeight: 309.44532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO4S2/c1-8(14)11(12(16)17)13-10(15)5-3-2-4-9(19)6-7-18/h8-9,11,14,18-19H,2-7H2,1H3,(H,13,15)(H,16,17)