hexadecyl-dimethyl-(8-oxidanyl-8-oxidanylidene-octyl)azanium bromide

Systemtic Name: hexadecyl-dimethyl-(8-oxidanyl-8-oxidanylidene-octyl)azanium bromide Openeye Name: hexadecyl-(8-hydroxy-8-oxo-octyl)-dimethyl-ammonium bromide CAS Name: hexadecyl-(8-hydroxy-8-oxooctyl)-dimethylammonium bromide IUPAC Name: hexadecyl-(8-hydroxy-8-oxooctyl)-dimethylazanium bromide Traditional Name: cetyl-(8-hydroxy-8-keto-octyl)-dimethyl-ammonium bromide Formula: C26H54BrNO2 MolecularWeight: 492.61646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCC(=O)O.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCC(=O)O.[Br-]

InChI

InChI=1S/C26H53NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-21-24-27(2,3)25-22-19-16-17-20-23-26(28)29;/h4-25H2,1-3H3;1H