6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azaniumyl]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azanium dibromide

Systemtic Name: 6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azaniumyl]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azanium dibromide Openeye Name: 6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]ammonio]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]ammonium dibromide CAS Name: 6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]ammonio]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]ammonium dibromide IUPAC Name: 6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azaniumyl]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]azanium dibromide Traditional Name: 6-[dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]ammonio]hexyl-dimethyl-[4-methyl-6-(2,2,6-trimethylcyclohexyl)hexyl]ammonium dibromide Formula: C42H86Br2N2 MolecularWeight: 778.95364

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1CCC(C)CCC[N+](C)(C)CCCCCC[N+](C)(C)CCCC(C)CCC2C(CCCC2(C)C)C)(C)C.[Br-].[Br-]

Isomeric SMILES

CC1CCCC(C1CCC(C)CCC[N+](C)(C)CCCCCC[N+](C)(C)CCCC(C)CCC2C(CCCC2(C)C)C)(C)C.[Br-].[Br-]

InChI

InChI=1S/C42H86N2.2BrH/c1-35(25-27-39-37(3)23-17-29-41(39,5)6)21-19-33-43(9,10)31-15-13-14-16-32-44(11,12)34-20-22-36(2)26-28-40-38(4)24-18-30-42(40,7)8;;/h35-40H,13-34H2,1-12H3;2*1H/q+2;;/p-2