(2S,4R)-4-(2-ethoxyethoxy)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1CC(N(C1)C(=O)C(C)CS)C(=O)O

Isomeric SMILES

CCOCCO[C@@H]1C[C@H](N(C1)C(=O)C(C)CS)C(=O)O

InChI

InChI=1S/C13H23NO5S/c1-3-18-4-5-19-10-6-11(13(16)17)14(7-10)12(15)9(2)8-20/h9-11,20H,3-8H2,1-2H3,(H,16,17)/t9?,10-,11+/m1/s1