4-chloranylbutyl-methyl-dioctyl-azanium bromide

Systemtic Name: 4-chloranylbutyl-methyl-dioctyl-azanium bromide Openeye Name: 4-chlorobutyl-methyl-dioctyl-ammonium bromide CAS Name: 4-chlorobutyl-methyl-dioctylammonium bromide IUPAC Name: 4-chlorobutyl-methyl-dioctylazanium bromide Traditional Name: 4-chlorobutyl-methyl-dioctyl-ammonium bromide Formula: C21H45BrClN MolecularWeight: 426.9457

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](C)(CCCCCCCC)CCCCCl.[Br-]

Isomeric SMILES

CCCCCCCC[N+](C)(CCCCCCCC)CCCCCl.[Br-]

InChI

InChI=1S/C21H45ClN.BrH/c1-4-6-8-10-12-15-19-23(3,21-17-14-18-22)20-16-13-11-9-7-5-2;/h4-21H2,1-3H3;1H/q+1;/p-1