4-methoxy-1-[2-(phenylmethylsulfanyl)ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-methoxy-1-[2-(phenylmethylsulfanyl)ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-benzylsulfanylacetyl)-4-methoxy-pyrrolidine-2-carboxylic acid CAS Name: 4-methoxy-1-[1-oxo-2-(phenylmethylthio)ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-benzylsulfanylacetyl)-4-methoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(benzylthio)acetyl]-4-methoxy-proline Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)CSCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC1CC(N(C1)C(=O)CSCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C15H19NO4S/c1-20-12-7-13(15(18)19)16(8-12)14(17)10-21-9-11-5-3-2-4-6-11/h2-6,12-13H,7-10H2,1H3,(H,18,19)