(2S,4S)-4-(4-methoxyphenoxy)-1-(2-sulfanylethanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,4S)-4-(4-methoxyphenoxy)-1-(2-sulfanylethanoyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,4S)-4-(4-methoxyphenoxy)-1-(2-sulfanylacetyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,4S)-1-(2-mercapto-1-oxoethyl)-4-(4-methoxyphenoxy)-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,4S)-4-(4-methoxyphenoxy)-1-(2-sulfanylacetyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,4S)-1-(2-mercaptoacetyl)-4-(4-methoxyphenoxy)proline Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2CC(N(C2)C(=O)CS)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)O[C@H]2C[C@H](N(C2)C(=O)CS)C(=O)O

InChI

InChI=1S/C14H17NO5S/c1-19-9-2-4-10(5-3-9)20-11-6-12(14(17)18)15(7-11)13(16)8-21/h2-5,11-12,21H,6-8H2,1H3,(H,17,18)/t11-,12-/m0/s1