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

Systemtic Name: 2-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]ethyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide Openeye Name: 2-[dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonio]ethyl-dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonium dibromide CAS Name: 2-[dimethyl-[4-(2,6,6-trimethyl-1-cyclohexenyl)butan-2-yl]ammonio]ethyl-dimethyl-[4-(2,6,6-trimethyl-1-cyclohexenyl)butan-2-yl]ammonium dibromide IUPAC Name: 2-[dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azaniumyl]ethyl-dimethyl-[4-(2,6,6-trimethylcyclohexen-1-yl)butan-2-yl]azanium dibromide Traditional Name: 2-[dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonio]ethyl-dimethyl-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)propyl]ammonium dibromide Formula: C32H62Br2N2 MolecularWeight: 634.65608

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C32H62N2.2BrH/c1-25-15-13-21-31(5,6)29(25)19-17-27(3)33(9,10)23-24-34(11,12)28(4)18-20-30-26(2)16-14-22-32(30,7)8;;/h27-28H,13-24H2,1-12H3;2*1H/q+2;;/p-2