5,5-bis(fluoranyl)-1-(2-methyl-3-sulfanyl-propanoyl)piperidine-2-carboxylic acid

Systemtic Name: 5,5-bis(fluoranyl)-1-(2-methyl-3-sulfanyl-propanoyl)piperidine-2-carboxylic acid Openeye Name: 5,5-difluoro-1-(2-methyl-3-sulfanyl-propanoyl)piperidine-2-carboxylic acid CAS Name: 5,5-difluoro-1-(3-mercapto-2-methyl-1-oxopropyl)-2-piperidinecarboxylic acid IUPAC Name: 5,5-difluoro-1-(2-methyl-3-sulfanylpropanoyl)piperidine-2-carboxylic acid Traditional Name: 5,5-difluoro-1-(3-mercapto-2-methyl-propanoyl)pipecolinic acid Formula: C10H15F2NO3S MolecularWeight: 267.292806

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)C(=O)N1CC(CCC1C(=O)O)(F)F

Isomeric SMILES

CC(CS)C(=O)N1CC(CCC1C(=O)O)(F)F

InChI

InChI=1S/C10H15F2NO3S/c1-6(4-17)8(14)13-5-10(11,12)3-2-7(13)9(15)16/h6-7,17H,2-5H2,1H3,(H,15,16)