4-(methylcarbamoyloxy)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(methylcarbamoyloxy)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(methylcarbamoyloxy)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(3-mercapto-2-methyl-1-oxopropyl)-4-(methylcarbamoyloxy)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(methylcarbamoyloxy)-1-(2-methyl-3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-(3-mercapto-2-methyl-propanoyl)-4-(methylcarbamoyloxy)proline Formula: C11H18N2O5S MolecularWeight: 290.33602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1CC(CC1C(=O)O)OC(=O)NC

Isomeric SMILES

CC(CS)C(=O)N1CC(CC1C(=O)O)OC(=O)NC

InChI

InChI=1S/C11H18N2O5S/c1-6(5-19)9(14)13-4-7(18-11(17)12-2)3-8(13)10(15)16/h6-8,19H,3-5H2,1-2H3,(H,12,17)(H,15,16)