(4-chloranyl-2-methyl-nonan-2-yl)-(2-oxidanylpropyl)azanium chloride

Systemtic Name: (4-chloranyl-2-methyl-nonan-2-yl)-(2-oxidanylpropyl)azanium chloride Openeye Name: (3-chloro-1,1-dimethyl-octyl)-(2-hydroxypropyl)ammonium chloride CAS Name: (4-chloro-2-methylnonan-2-yl)-(2-hydroxypropyl)ammonium chloride IUPAC Name: (4-chloro-2-methylnonan-2-yl)-(2-hydroxypropyl)azanium chloride Traditional Name: (3-chloro-1,1-dimethyl-octyl)-(2-hydroxypropyl)ammonium chloride Formula: C13H29Cl2NO MolecularWeight: 286.28146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(C)(C)[NH2+]CC(C)O)Cl.[Cl-]

Isomeric SMILES

CCCCCC(CC(C)(C)[NH2+]CC(C)O)Cl.[Cl-]

InChI

InChI=1S/C13H28ClNO.ClH/c1-5-6-7-8-12(14)9-13(3,4)15-10-11(2)16;/h11-12,15-16H,5-10H2,1-4H3;1H