(2S)-1-[(2S)-3-ethanoylsulfanyl-2-methyl-propanoyl]-4,4-dimethoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2S)-3-ethanoylsulfanyl-2-methyl-propanoyl]-4,4-dimethoxy-pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2S)-3-acetylsulfanyl-2-methyl-propanoyl]-4,4-dimethoxy-pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2S)-3-(acetylthio)-2-methyl-1-oxopropyl]-4,4-dimethoxy-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2S)-3-acetylsulfanyl-2-methylpropanoyl]-4,4-dimethoxypyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2S)-3-(acetylthio)-2-methyl-propanoyl]-4,4-dimethoxy-proline Formula: C13H21NO6S MolecularWeight: 319.37394

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)(OC)OC

Isomeric SMILES

C[C@H](CSC(=O)C)C(=O)N1CC(C[C@H]1C(=O)O)(OC)OC

InChI

InChI=1S/C13H21NO6S/c1-8(6-21-9(2)15)11(16)14-7-13(19-3,20-4)5-10(14)12(17)18/h8,10H,5-7H2,1-4H3,(H,17,18)/t8-,10+/m1/s1