ethyl-[6-[ethyl-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]hexyl]-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide

Systemtic Name: ethyl-[6-[ethyl-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]hexyl]-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide Openeye Name: ethyl-[6-[ethyl-methyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonio]hexyl]-methyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonium dibromide CAS Name: ethyl-[6-[ethyl-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]ammonio]hexyl]-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]ammonium dibromide IUPAC Name: ethyl-[6-[ethyl-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azaniumyl]hexyl]-methyl-[4-(2,2,6-trimethylcyclohexyl)butan-2-yl]azanium dibromide Traditional Name: ethyl-[6-[ethyl-methyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonio]hexyl]-methyl-[1-methyl-3-(2,2,6-trimethylcyclohexyl)propyl]ammonium dibromide Formula: C38H78Br2N2 MolecularWeight: 722.84732

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CCCCCC[N+](C)(CC)C(C)CCC1C(CCCC1(C)C)C)C(C)CCC2C(CCCC2(C)C)C.[Br-].[Br-]

Isomeric SMILES

CC[N+](C)(CCCCCC[N+](C)(CC)C(C)CCC1C(CCCC1(C)C)C)C(C)CCC2C(CCCC2(C)C)C.[Br-].[Br-]

InChI

InChI=1S/C38H78N2.2BrH/c1-13-39(11,33(5)23-25-35-31(3)21-19-27-37(35,7)8)29-17-15-16-18-30-40(12,14-2)34(6)24-26-36-32(4)22-20-28-38(36,9)10;;/h31-36H,13-30H2,1-12H3;2*1H/q+2;;/p-2