dimethyl (2S,5R)-5-phenylsulfanylpyrrolidine-1,2-dicarboxylate

Systemtic Name: dimethyl (2S,5R)-5-phenylsulfanylpyrrolidine-1,2-dicarboxylate Openeye Name: dimethyl (2S,5R)-5-phenylsulfanylpyrrolidine-1,2-dicarboxylate CAS Name: (2S,5R)-5-(phenylthio)pyrrolidine-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,5R)-5-phenylsulfanylpyrrolidine-1,2-dicarboxylate Traditional Name: (2S,5R)-5-(phenylthio)pyrrolidine-1,2-dicarboxylic acid dimethyl ester Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(N1C(=O)OC)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1CC[C@H](N1C(=O)OC)SC2=CC=CC=C2

InChI

InChI=1S/C14H17NO4S/c1-18-13(16)11-8-9-12(15(11)14(17)19-2)20-10-6-4-3-5-7-10/h3-7,11-12H,8-9H2,1-2H3/t11-,12+/m0/s1