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

Systemtic Name: 1-[2-(2-fluorophenyl)sulfanylethanoyl]-4-methoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(2-fluorophenyl)sulfanylacetyl]-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(2-fluorophenyl)thio]-1-oxoethyl]-4-methoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(2-fluorophenyl)sulfanylacetyl]-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(2-fluorophenyl)thio]acetyl]-4-methoxy-proline Formula: C14H16FNO4S MolecularWeight: 313.344543

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)CSC2=CC=CC=C2F)C(=O)O

Isomeric SMILES

COC1CC(N(C1)C(=O)CSC2=CC=CC=C2F)C(=O)O

InChI

InChI=1S/C14H16FNO4S/c1-20-9-6-11(14(18)19)16(7-9)13(17)8-21-12-5-3-2-4-10(12)15/h2-5,9,11H,6-8H2,1H3,(H,18,19)