3-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]propyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide

Systemtic Name: 3-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]propyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide Openeye Name: 3-[dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonio]propyl-dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonium dibromide CAS Name: 3-[dimethyl-[4-(2,6,6-trimethyl-1-cyclohexenyl)butan-2-yl]ammonio]propyl-dimethyl-[4-(2,6,6-trimethyl-1-cyclohexenyl)butan-2-yl]ammonium dibromide IUPAC Name: 3-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]propyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide Traditional Name: 3-[dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonio]propyl-dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonium dibromide Formula: C33H64Br2N2 MolecularWeight: 648.68266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CCC(C)[N+](C)(C)CCC[N+](C)(C)C(C)CCC2=C(CCCC2(C)C)C.[Br-].[Br-]

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CCC(C)[N+](C)(C)CCC[N+](C)(C)C(C)CCC2=C(CCCC2(C)C)C.[Br-].[Br-]

InChI

InChI=1S/C33H64N2.2BrH/c1-26-16-13-22-32(5,6)30(26)20-18-28(3)34(9,10)24-15-25-35(11,12)29(4)19-21-31-27(2)17-14-23-33(31,7)8;;/h28-29H,13-25H2,1-12H3;2*1H/q+2;;/p-2