3-[2-oxidanyl-2-oxidanylidene-1-(propanoylamino)ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-oxidanyl-2-oxidanylidene-1-(propanoylamino)ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-hydroxy-2-oxo-1-(propanoylamino)ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-hydroxy-2-oxo-1-(1-oxopropylamino)ethyl]thio]propanoic acid IUPAC Name: 3-[2-hydroxy-2-oxo-1-(propanoylamino)ethyl]sulfanylpropanoic acid Traditional Name: 3-[(2-hydroxy-2-keto-1-propionamido-ethyl)thio]propionic acid Formula: C8H13NO5S MolecularWeight: 235.25752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(C(=O)O)SCCC(=O)O

Isomeric SMILES

CCC(=O)NC(C(=O)O)SCCC(=O)O

InChI

InChI=1S/C8H13NO5S/c1-2-5(10)9-7(8(13)14)15-4-3-6(11)12/h7H,2-4H2,1H3,(H,9,10)(H,11,12)(H,13,14)