6-[bis(2-hydroxyethyl)-tetradecyl-azaniumyl]hexyl-bis(2-hydroxyethyl)-tetradecyl-azanium dibromide

Systemtic Name: 6-[bis(2-hydroxyethyl)-tetradecyl-azaniumyl]hexyl-bis(2-hydroxyethyl)-tetradecyl-azanium dibromide Openeye Name: 6-[bis(2-hydroxyethyl)-tetradecyl-ammonio]hexyl-bis(2-hydroxyethyl)-tetradecyl-ammonium dibromide CAS Name: 6-[bis(2-hydroxyethyl)-tetradecylammonio]hexyl-bis(2-hydroxyethyl)-tetradecylammonium dibromide IUPAC Name: 6-[bis(2-hydroxyethyl)-tetradecylazaniumyl]hexyl-bis(2-hydroxyethyl)-tetradecylazanium dibromide Traditional Name: 6-[bis(2-hydroxyethyl)-myristyl-ammonio]hexyl-bis(2-hydroxyethyl)-myristyl-ammonium dibromide Formula: C42H90Br2N2O4 MolecularWeight: 846.983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](CCCCCC[N+](CCCCCCCCCCCCCC)(CCO)CCO)(CCO)CCO.[Br-].[Br-]

Isomeric SMILES

CCCCCCCCCCCCCC[N+](CCCCCC[N+](CCCCCCCCCCCCCC)(CCO)CCO)(CCO)CCO.[Br-].[Br-]

InChI

InChI=1S/C42H90N2O4.2BrH/c1-3-5-7-9-11-13-15-17-19-21-23-27-31-43(35-39-45,36-40-46)33-29-25-26-30-34-44(37-41-47,38-42-48)32-28-24-22-20-18-16-14-12-10-8-6-4-2;;/h45-48H,3-42H2,1-2H3;2*1H/q+2;;/p-2