1-bromanyloctadecan-7-yl(dimethyl)azanium bromide

Systemtic Name: 1-bromanyloctadecan-7-yl(dimethyl)azanium bromide Openeye Name: 1-(6-bromohexyl)dodecyl-dimethyl-ammonium bromide CAS Name: 1-bromooctadecan-7-yl(dimethyl)ammonium bromide IUPAC Name: 1-bromooctadecan-7-yl(dimethyl)azanium bromide Traditional Name: 1-(6-bromohexyl)dodecyl-dimethyl-ammonium bromide Formula: C20H43Br2N MolecularWeight: 457.37012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(CCCCCCBr)[NH+](C)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCC(CCCCCCBr)[NH+](C)C.[Br-]

InChI

InChI=1S/C20H42BrN.BrH/c1-4-5-6-7-8-9-10-11-14-17-20(22(2)3)18-15-12-13-16-19-21;/h20H,4-19H2,1-3H3;1H