hexadecyl-[4-[hexadecyl(dimethyl)azaniumyl]butyl]-dimethyl-azanium dibromide

Systemtic Name: hexadecyl-[4-[hexadecyl(dimethyl)azaniumyl]butyl]-dimethyl-azanium dibromide Openeye Name: hexadecyl-[4-[hexadecyl(dimethyl)ammonio]butyl]-dimethyl-ammonium dibromide CAS Name: hexadecyl-[4-[hexadecyl(dimethyl)ammonio]butyl]-dimethylammonium dibromide IUPAC Name: hexadecyl-[4-[hexadecyl(dimethyl)azaniumyl]butyl]-dimethylazanium dibromide Traditional Name: cetyl-[4-[cetyl(dimethyl)ammonio]butyl]-dimethyl-ammonium dibromide Formula: C40H86Br2N2 MolecularWeight: 754.93224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H86N2.2BrH/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-41(3,4)39-35-36-40-42(5,6)38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2;;/h7-40H2,1-6H3;2*1H/q+2;;/p-2