14-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]tetradecyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide

Systemtic Name: 14-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]tetradecyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide Openeye Name: 14-[dimethyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonio]tetradecyl-dimethyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonium dibromide CAS Name: 14-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]ammonio]tetradecyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]ammonium dibromide IUPAC Name: 14-[dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]tetradecyl-dimethyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide Traditional Name: 14-[dimethyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonio]tetradecyl-dimethyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonium dibromide Formula: C44H90Br2N2 MolecularWeight: 807.0068

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1CCC(C)[N+](C)(C)CCCCCCCCCCCCCC[N+](C)(C)C(C)CCC2C(CCCC2(C)C)C)(C)C.[Br-].[Br-]

Isomeric SMILES

CC1CCCC(C1CCC(C)[N+](C)(C)CCCCCCCCCCCCCC[N+](C)(C)C(C)CCC2C(CCCC2(C)C)C)(C)C.[Br-].[Br-]

InChI

InChI=1S/C44H90N2.2BrH/c1-37-27-25-33-43(5,6)41(37)31-29-39(3)45(9,10)35-23-21-19-17-15-13-14-16-18-20-22-24-36-46(11,12)40(4)30-32-42-38(2)28-26-34-44(42,7)8;;/h37-42H,13-36H2,1-12H3;2*1H/q+2;;/p-2