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

Systemtic Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-1-ium bromide Openeye Name: 1,3-bis(2,6-diisopropylphenyl)imidazol-1-ium bromide CAS Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-1-ium bromide IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-1-ium bromide Traditional Name: 1,3-bis(2,6-diisopropylphenyl)imidazol-1-ium bromide Formula: C27H37BrN2 MolecularWeight: 469.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2)C3=C(C=CC=C3C(C)C)C(C)C.[Br-]

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)N2C=C[N+](=C2)C3=C(C=CC=C3C(C)C)C(C)C.[Br-]

InChI

InChI=1S/C27H37N2.BrH/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;/h9-21H,1-8H3;1H/q+1;/p-1