2-[4-[2-[diethyl(octyl)azaniumyl]ethyl]piperazin-1-yl]ethyl-diethyl-octyl-azanium dibromide

Systemtic Name: 2-[4-[2-[diethyl(octyl)azaniumyl]ethyl]piperazin-1-yl]ethyl-diethyl-octyl-azanium dibromide Openeye Name: 2-[4-[2-[diethyl(octyl)ammonio]ethyl]piperazin-1-yl]ethyl-diethyl-octyl-ammonium dibromide CAS Name: 2-[4-[2-[diethyl(octyl)ammonio]ethyl]-1-piperazinyl]ethyl-diethyl-octylammonium dibromide IUPAC Name: 2-[4-[2-[diethyl(octyl)azaniumyl]ethyl]piperazin-1-yl]ethyl-diethyl-octylazanium dibromide Traditional Name: 2-[4-[2-[diethyl(octyl)ammonio]ethyl]piperazino]ethyl-diethyl-octyl-ammonium dibromide Formula: C32H70Br2N4 MolecularWeight: 670.733

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[N+](CC)(CC)CCN1CCN(CC1)CC[N+](CC)(CC)CCCCCCCC.[Br-].[Br-]

Isomeric SMILES

CCCCCCCC[N+](CC)(CC)CCN1CCN(CC1)CC[N+](CC)(CC)CCCCCCCC.[Br-].[Br-]

InChI

InChI=1S/C32H70N4.2BrH/c1-7-13-15-17-19-21-29-35(9-3,10-4)31-27-33-23-25-34(26-24-33)28-32-36(11-5,12-6)30-22-20-18-16-14-8-2;;/h7-32H2,1-6H3;2*1H/q+2;;/p-2