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

Systemtic Name: heptadecyl-dimethyl-(11-oxidanyl-11-oxidanylidene-undecyl)azanium bromide Openeye Name: heptadecyl-(11-hydroxy-11-oxo-undecyl)-dimethyl-ammonium bromide CAS Name: heptadecyl-(11-hydroxy-11-oxoundecyl)-dimethylammonium bromide IUPAC Name: heptadecyl-(11-hydroxy-11-oxoundecyl)-dimethylazanium bromide Traditional Name: heptadecyl-(11-hydroxy-11-keto-undecyl)-dimethyl-ammonium bromide Formula: C30H62BrNO2 MolecularWeight: 548.72278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H61NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-16-19-22-25-28-31(2,3)29-26-23-20-17-15-18-21-24-27-30(32)33;/h4-29H2,1-3H3;1H