(2S,4S)-1-(3-ethanoylsulfanylpropanoyl)-4-methoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-1-(3-ethanoylsulfanylpropanoyl)-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-1-(3-acetylsulfanylpropanoyl)-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-1-[3-(acetylthio)-1-oxopropyl]-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-1-(3-acetylsulfanylpropanoyl)-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-[3-(acetylthio)propanoyl]-4-methoxy-proline Formula: C11H17NO5S MolecularWeight: 275.32138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(=O)N1CC(CC1C(=O)O)OC

Isomeric SMILES

CC(=O)SCCC(=O)N1C[C@H](C[C@H]1C(=O)O)OC

InChI

InChI=1S/C11H17NO5S/c1-7(13)18-4-3-10(14)12-6-8(17-2)5-9(12)11(15)16/h8-9H,3-6H2,1-2H3,(H,15,16)/t8-,9-/m0/s1