1-[2-(2-chlorophenyl)sulfanylethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(2-chlorophenyl)sulfanylethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(2-chlorophenyl)sulfanylacetyl]-4-hydroxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-chlorophenyl)thio]-1-oxoethyl]-4-hydroxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(2-chlorophenyl)sulfanylacetyl]-4-hydroxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(2-chlorophenyl)thio]acetyl]-4-hydroxy-proline Formula: C13H14ClNO4S MolecularWeight: 315.77256

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1C(=O)O)C(=O)CSC2=CC=CC=C2Cl)O

Isomeric SMILES

C1C(CN(C1C(=O)O)C(=O)CSC2=CC=CC=C2Cl)O

InChI

InChI=1S/C13H14ClNO4S/c14-9-3-1-2-4-11(9)20-7-12(17)15-6-8(16)5-10(15)13(18)19/h1-4,8,10,16H,5-7H2,(H,18,19)