dodecyl-bis[3-[dodecyl(dimethyl)azaniumyl]propyl]-methyl-azanium tribromide

Systemtic Name: dodecyl-bis[3-[dodecyl(dimethyl)azaniumyl]propyl]-methyl-azanium tribromide Openeye Name: dodecyl-bis[3-[dodecyl(dimethyl)ammonio]propyl]-methyl-ammonium tribromide CAS Name: dodecyl-bis[3-[dodecyl(dimethyl)ammonio]propyl]-methylammonium tribromide IUPAC Name: dodecyl-bis[3-[dodecyl(dimethyl)azaniumyl]propyl]-methylazanium tribromide Traditional Name: lauryl-bis[3-[lauryl(dimethyl)ammonio]propyl]-methyl-ammonium tribromide Formula: C47H102Br3N3 MolecularWeight: 949.04488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CCC[N+](C)(CCCCCCCCCCCC)CCC[N+](C)(C)CCCCCCCCCCCC.[Br-].[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CCC[N+](C)(CCCCCCCCCCCC)CCC[N+](C)(C)CCCCCCCCCCCC.[Br-].[Br-].[Br-]

InChI

InChI=1S/C47H102N3.3BrH/c1-9-12-15-18-21-24-27-30-33-36-41-48(4,5)43-39-46-50(8,45-38-35-32-29-26-23-20-17-14-11-3)47-40-44-49(6,7)42-37-34-31-28-25-22-19-16-13-10-2;;;/h9-47H2,1-8H3;3*1H/q+3;;;/p-3