1-(3-ethanoylsulfanylpropanoyl)-4,4-dimethoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanylpropanoyl)-4,4-dimethoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanylpropanoyl)-4,4-dimethoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-1-oxopropyl]-4,4-dimethoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanylpropanoyl)-4,4-dimethoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)propanoyl]-4,4-dimethoxy-proline Formula: C12H19NO6S MolecularWeight: 305.34736

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(=O)N1CC(CC1C(=O)O)(OC)OC

Isomeric SMILES

CC(=O)SCCC(=O)N1CC(CC1C(=O)O)(OC)OC

InChI

InChI=1S/C12H19NO6S/c1-8(14)20-5-4-10(15)13-7-12(18-2,19-3)6-9(13)11(16)17/h9H,4-7H2,1-3H3,(H,16,17)