butyl-bis[6-[butyl(diethyl)azaniumyl]hexyl]-ethyl-azanium triiodide

Systemtic Name: butyl-bis[6-[butyl(diethyl)azaniumyl]hexyl]-ethyl-azanium triiodide Openeye Name: butyl-bis[6-[butyl(diethyl)ammonio]hexyl]-ethyl-ammonium triiodide CAS Name: butyl-bis[6-[butyl(diethyl)ammonio]hexyl]-ethylammonium triiodide IUPAC Name: butyl-bis[6-[butyl(diethyl)azaniumyl]hexyl]-ethylazanium triiodide Traditional Name: butyl-bis[6-[butyl(diethyl)ammonio]hexyl]-ethyl-ammonium triiodide Formula: C34H76I3N3 MolecularWeight: 907.70075

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CC)(CC)CCCCCC[N+](CC)(CCCC)CCCCCC[N+](CC)(CC)CCCC.[I-].[I-].[I-]

Isomeric SMILES

CCCC[N+](CC)(CC)CCCCCC[N+](CC)(CCCC)CCCCCC[N+](CC)(CC)CCCC.[I-].[I-].[I-]

InChI

InChI=1S/C34H76N3.3HI/c1-9-17-28-35(12-4,13-5)31-24-20-22-26-33-37(16-8,30-19-11-3)34-27-23-21-25-32-36(14-6,15-7)29-18-10-2;;;/h9-34H2,1-8H3;3*1H/q+3;;;/p-3