dimethyl-octadecyl-(11-oxidanyl-11-oxidanylidene-undecyl)azanium bromide

Systemtic Name: dimethyl-octadecyl-(11-oxidanyl-11-oxidanylidene-undecyl)azanium bromide Openeye Name: (11-hydroxy-11-oxo-undecyl)-dimethyl-octadecyl-ammonium bromide CAS Name: (11-hydroxy-11-oxoundecyl)-dimethyl-octadecylammonium bromide IUPAC Name: (11-hydroxy-11-oxoundecyl)-dimethyl-octadecylazanium bromide Traditional Name: (11-hydroxy-11-keto-undecyl)-dimethyl-stearyl-ammonium bromide Formula: C31H64BrNO2 MolecularWeight: 562.74936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCC(=O)O.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCC(=O)O.[Br-]

InChI

InChI=1S/C31H63NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23-26-29-32(2,3)30-27-24-21-18-16-19-22-25-28-31(33)34;/h4-30H2,1-3H3;1H