1-(3-ethanoylsulfanylpropanoyl)-4-ethyl-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanylpropanoyl)-4-ethyl-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanylpropanoyl)-4-ethyl-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-1-oxopropyl]-4-ethyl-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanylpropanoyl)-4-ethyl-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)propanoyl]-4-ethyl-4-hydroxy-proline Formula: C12H19NO5S MolecularWeight: 289.34796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(N(C1)C(=O)CCSC(=O)C)C(=O)O)O

Isomeric SMILES

CCC1(CC(N(C1)C(=O)CCSC(=O)C)C(=O)O)O

InChI

InChI=1S/C12H19NO5S/c1-3-12(18)6-9(11(16)17)13(7-12)10(15)4-5-19-8(2)14/h9,18H,3-7H2,1-2H3,(H,16,17)