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

Systemtic Name: 4,4-diethoxy-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 4,4-diethoxy-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid CAS Name: 4,4-diethoxy-1-(3-mercapto-2-methyl-1-oxopropyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4,4-diethoxy-1-(2-methyl-3-sulfanylpropanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 4,4-diethoxy-1-(3-mercapto-2-methyl-propanoyl)proline Formula: C13H23NO5S MolecularWeight: 305.39042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CC(N(C1)C(=O)C(C)CS)C(=O)O)OCC

Isomeric SMILES

CCOC1(CC(N(C1)C(=O)C(C)CS)C(=O)O)OCC

InChI

InChI=1S/C13H23NO5S/c1-4-18-13(19-5-2)6-10(12(16)17)14(8-13)11(15)9(3)7-20/h9-10,20H,4-8H2,1-3H3,(H,16,17)