4-methoxy-1-(2-methylsulfanylphenyl)carbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-methoxy-1-(2-methylsulfanylphenyl)carbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-methoxy-1-(2-methylsulfanylbenzoyl)pyrrolidine-2-carboxylic acid CAS Name: 4-methoxy-1-[[2-(methylthio)phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-methoxy-1-(2-methylsulfanylbenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-methoxy-1-[2-(methylthio)benzoyl]proline Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(N(C1)C(=O)C2=CC=CC=C2SC)C(=O)O

Isomeric SMILES

COC1CC(N(C1)C(=O)C2=CC=CC=C2SC)C(=O)O

InChI

InChI=1S/C14H17NO4S/c1-19-9-7-11(14(17)18)15(8-9)13(16)10-5-3-4-6-12(10)20-2/h3-6,9,11H,7-8H2,1-2H3,(H,17,18)