1-[2,6-di(propan-2-yl)phenyl]-3-[[2-[[3-[2,6-di(propan-2-yl)phenyl]imidazol-1-ium-1-yl]methyl]phenyl]methyl]imidazol-3-ium dibromide

Systemtic Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[[2-[[3-[2,6-di(propan-2-yl)phenyl]imidazol-1-ium-1-yl]methyl]phenyl]methyl]imidazol-3-ium dibromide Openeye Name: 1-(2,6-diisopropylphenyl)-3-[[2-[[3-(2,6-diisopropylphenyl)imidazol-1-ium-1-yl]methyl]phenyl]methyl]imidazol-3-ium dibromide CAS Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[[2-[[3-[2,6-di(propan-2-yl)phenyl]-1-imidazol-1-iumyl]methyl]phenyl]methyl]imidazol-3-ium dibromide IUPAC Name: 1-[2,6-di(propan-2-yl)phenyl]-3-[[2-[[3-[2,6-di(propan-2-yl)phenyl]imidazol-1-ium-1-yl]methyl]phenyl]methyl]imidazol-3-ium dibromide Traditional Name: 1-(2,6-diisopropylphenyl)-3-[2-[[3-(2,6-diisopropylphenyl)imidazol-1-ium-1-yl]methyl]benzyl]imidazol-3-ium dibromide Formula: C38H48Br2N4 MolecularWeight: 720.62252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2)CC3=CC=CC=C3C[N+]4=CN(C=C4)C5=C(C=CC=C5C(C)C)C(C)C.[Br-].[Br-]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2)CC3=CC=CC=C3C[N+]4=CN(C=C4)C5=C(C=CC=C5C(C)C)C(C)C.[Br-].[Br-]

InChI

InChI=1S/C38H48N4.2BrH/c1-27(2)33-15-11-16-34(28(3)4)37(33)41-21-19-39(25-41)23-31-13-9-10-14-32(31)24-40-20-22-42(26-40)38-35(29(5)6)17-12-18-36(38)30(7)8;;/h9-22,25-30H,23-24H2,1-8H3;2*1H/q+2;;/p-2