4-oxidanylidene-4-pentoxy-2,3-bis(sulfanyl)butanoic acid

Systemtic Name: 4-oxidanylidene-4-pentoxy-2,3-bis(sulfanyl)butanoic acid Openeye Name: 4-oxo-4-pentoxy-2,3-bis(sulfanyl)butanoic acid CAS Name: 2,3-dimercapto-4-oxo-4-pentoxybutanoic acid IUPAC Name: 4-oxo-4-pentoxy-2,3-bis(sulfanyl)butanoic acid Traditional Name: 4-amoxy-4-keto-2,3-dimercapto-butyric acid Formula: C9H16O4S2 MolecularWeight: 252.35094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C(C(C(=O)O)S)S

Isomeric SMILES

CCCCCOC(=O)C(C(C(=O)O)S)S

InChI

InChI=1S/C9H16O4S2/c1-2-3-4-5-13-9(12)7(15)6(14)8(10)11/h6-7,14-15H,2-5H2,1H3,(H,10,11)