[(3S)-2,2-bis(fluoranyl)-1-oxidanyl-1-oxidanylidene-octan-3-yl]azanium chloride

Systemtic Name: [(3S)-2,2-bis(fluoranyl)-1-oxidanyl-1-oxidanylidene-octan-3-yl]azanium chloride Openeye Name: [(1S)-1-(1,1-difluoro-2-hydroxy-2-oxo-ethyl)hexyl]ammonium chloride CAS Name: [(3S)-2,2-difluoro-1-hydroxy-1-oxooctan-3-yl]ammonium chloride IUPAC Name: [(3S)-2,2-difluoro-1-hydroxy-1-oxooctan-3-yl]azanium chloride Traditional Name: [(1S)-1-(1,1-difluoro-2-hydroxy-2-keto-ethyl)hexyl]ammonium chloride Formula: C8H16ClF2NO2 MolecularWeight: 231.667946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C(=O)O)(F)F)[NH3+].[Cl-]

Isomeric SMILES

CCCCC[C@@H](C(C(=O)O)(F)F)[NH3+].[Cl-]

InChI

InChI=1S/C8H15F2NO2.ClH/c1-2-3-4-5-6(11)8(9,10)7(12)13;/h6H,2-5,11H2,1H3,(H,12,13);1H/t6-;/m0./s1