1,3-bis[2,6-di(propan-2-yl)phenyl]-5,5-dimethyl-4H-imidazol-3-ium bromide

Systemtic Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-5,5-dimethyl-4H-imidazol-3-ium bromide Openeye Name: 1,3-bis(2,6-diisopropylphenyl)-5,5-dimethyl-4H-imidazol-3-ium bromide CAS Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-5,5-dimethyl-4H-imidazol-3-ium bromide IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-5,5-dimethyl-4H-imidazol-3-ium bromide Traditional Name: 1,3-bis(2,6-diisopropylphenyl)-4,4-dimethyl-2-imidazolin-1-ium bromide Formula: C29H43BrN2 MolecularWeight: 499.56912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=[N+](CC2(C)C)C3=C(C=CC=C3C(C)C)C(C)C.[Br-]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=[N+](CC2(C)C)C3=C(C=CC=C3C(C)C)C(C)C.[Br-]

InChI

InChI=1S/C29H43N2.BrH/c1-19(2)23-13-11-14-24(20(3)4)27(23)30-17-29(9,10)31(18-30)28-25(21(5)6)15-12-16-26(28)22(7)8;/h11-16,18-22H,17H2,1-10H3;1H/q+1;/p-1