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

Systemtic Name: 1-[2-(2-methylphenyl)sulfanylethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[2-(o-tolylsulfanyl)acetyl]pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[2-[(2-methylphenyl)thio]-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[2-(2-methylphenyl)sulfanylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[2-(o-tolylthio)acetyl]proline Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C14H17NO4S/c1-9-4-2-3-5-12(9)20-8-13(17)15-7-10(16)6-11(15)14(18)19/h2-5,10-11,16H,6-8H2,1H3,(H,18,19)