[(1R,2S)-1-oxidanyl-1-phenyl-heptan-2-yl]azanium chloride

Systemtic Name: [(1R,2S)-1-oxidanyl-1-phenyl-heptan-2-yl]azanium chloride Openeye Name: [(1S)-1-[(R)-hydroxy(phenyl)methyl]hexyl]ammonium chloride CAS Name: [(1R,2S)-1-hydroxy-1-phenylheptan-2-yl]ammonium chloride IUPAC Name: [(1R,2S)-1-hydroxy-1-phenylheptan-2-yl]azanium chloride Traditional Name: [(1S)-1-[(R)-hydroxy(phenyl)methyl]hexyl]ammonium chloride Formula: C13H22ClNO MolecularWeight: 243.77288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C1=CC=CC=C1)O)[NH3+].[Cl-]

Isomeric SMILES

CCCCC[C@@H]([C@@H](C1=CC=CC=C1)O)[NH3+].[Cl-]

InChI

InChI=1S/C13H21NO.ClH/c1-2-3-5-10-12(14)13(15)11-8-6-4-7-9-11;/h4,6-9,12-13,15H,2-3,5,10,14H2,1H3;1H/t12-,13+;/m0./s1