1-[2-(ethanoylsulfanylmethyl)butanoyl]-4,4-dimethoxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-(ethanoylsulfanylmethyl)butanoyl]-4,4-dimethoxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(acetylsulfanylmethyl)butanoyl]-4,4-dimethoxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(acetylthio)methyl]-1-oxobutyl]-4,4-dimethoxy-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-(acetylsulfanylmethyl)butanoyl]-4,4-dimethoxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(acetylthio)methyl]butanoyl]-4,4-dimethoxy-proline Formula: C14H23NO6S MolecularWeight: 333.40052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO6S/c1-5-10(7-22-9(2)16)12(17)15-8-14(20-3,21-4)6-11(15)13(18)19/h10-11H,5-8H2,1-4H3,(H,18,19)