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

Systemtic Name: 1-[2-(4-fluorophenyl)sulfanylethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(4-fluorophenyl)sulfanylacetyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(4-fluorophenyl)thio]-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(4-fluorophenyl)sulfanylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(4-fluorophenyl)thio]acetyl]proline Formula: C13H14FNO3S MolecularWeight: 283.318563

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSC2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)CSC2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C13H14FNO3S/c14-9-3-5-10(6-4-9)19-8-12(16)15-7-1-2-11(15)13(17)18/h3-6,11H,1-2,7-8H2,(H,17,18)