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

Systemtic Name: 1-[2-(2-methylphenyl)sulfanylethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(o-tolylsulfanyl)acetyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-methylphenyl)thio]-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(2-methylphenyl)sulfanylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(o-tolylthio)acetyl]proline Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C14H17NO3S/c1-10-5-2-3-7-12(10)19-9-13(16)15-8-4-6-11(15)14(17)18/h2-3,5,7,11H,4,6,8-9H2,1H3,(H,17,18)