1-(3-ethanoylsulfanylbutanoyl)-4,4-bis(fluoranyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanylbutanoyl)-4,4-bis(fluoranyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanylbutanoyl)-4,4-difluoro-pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-1-oxobutyl]-4,4-difluoro-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanylbutanoyl)-4,4-difluoropyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)butanoyl]-4,4-difluoro-proline Formula: C11H15F2NO4S MolecularWeight: 295.302906

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CC(CC1C(=O)O)(F)F)SC(=O)C

Isomeric SMILES

CC(CC(=O)N1CC(CC1C(=O)O)(F)F)SC(=O)C

InChI

InChI=1S/C11H15F2NO4S/c1-6(19-7(2)15)3-9(16)14-5-11(12,13)4-8(14)10(17)18/h6,8H,3-5H2,1-2H3,(H,17,18)