hexadecyl-dimethyl-(3-oxidanylpropyl)azanium bromide

Systemtic Name: hexadecyl-dimethyl-(3-oxidanylpropyl)azanium bromide Openeye Name: hexadecyl-(3-hydroxypropyl)-dimethyl-ammonium bromide CAS Name: hexadecyl-(3-hydroxypropyl)-dimethylammonium bromide IUPAC Name: hexadecyl-(3-hydroxypropyl)-dimethylazanium bromide Traditional Name: cetyl-(3-hydroxypropyl)-dimethyl-ammonium bromide Formula: C21H46BrNO MolecularWeight: 408.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CCCO.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CCCO.[Br-]

InChI

InChI=1S/C21H46NO.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(2,3)20-18-21-23;/h23H,4-21H2,1-3H3;1H/q+1;/p-1