10-[dimethyl-(phenylmethyl)azaniumyl]decyl-dimethyl-(phenylmethyl)azanium dibromide

Systemtic Name: 10-[dimethyl-(phenylmethyl)azaniumyl]decyl-dimethyl-(phenylmethyl)azanium dibromide Openeye Name: benzyl-[10-[benzyl(dimethyl)ammonio]decyl]-dimethyl-ammonium dibromide CAS Name: 10-[dimethyl-(phenylmethyl)ammonio]decyl-dimethyl-(phenylmethyl)ammonium dibromide IUPAC Name: benzyl-[10-[benzyl(dimethyl)azaniumyl]decyl]-dimethylazanium dibromide Traditional Name: benzyl-[10-[benzyl(dimethyl)ammonio]decyl]-dimethyl-ammonium dibromide Formula: C28H46Br2N2 MolecularWeight: 570.48624

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1)CC2=CC=CC=C2.[Br-].[Br-]

Isomeric SMILES

C[N+](C)(CCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1)CC2=CC=CC=C2.[Br-].[Br-]

InChI

InChI=1S/C28H46N2.2BrH/c1-29(2,25-27-19-13-11-14-20-27)23-17-9-7-5-6-8-10-18-24-30(3,4)26-28-21-15-12-16-22-28;;/h11-16,19-22H,5-10,17-18,23-26H2,1-4H3;2*1H/q+2;;/p-2