1,3-bis[(3,4-dichlorophenyl)methyl]-2-phenyl-4,5-dihydroimidazol-1-ium bromide

Systemtic Name: 1,3-bis[(3,4-dichlorophenyl)methyl]-2-phenyl-4,5-dihydroimidazol-1-ium bromide Openeye Name: 1,3-bis[(3,4-dichlorophenyl)methyl]-2-phenyl-4,5-dihydroimidazol-1-ium bromide CAS Name: 1,3-bis[(3,4-dichlorophenyl)methyl]-2-phenyl-4,5-dihydroimidazol-1-ium bromide IUPAC Name: 1,3-bis[(3,4-dichlorophenyl)methyl]-2-phenyl-4,5-dihydroimidazol-1-ium bromide Traditional Name: 1,3-bis(3,4-dichlorobenzyl)-2-phenyl-2-imidazolin-1-ium bromide Formula: C23H19BrCl4N2 MolecularWeight: 545.12636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C(N1CC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)CC4=CC(=C(C=C4)Cl)Cl.[Br-]

Isomeric SMILES

C1C[N+](=C(N1CC2=CC(=C(C=C2)Cl)Cl)C3=CC=CC=C3)CC4=CC(=C(C=C4)Cl)Cl.[Br-]

InChI

InChI=1S/C23H19Cl4N2.BrH/c24-19-8-6-16(12-21(19)26)14-28-10-11-29(23(28)18-4-2-1-3-5-18)15-17-7-9-20(25)22(27)13-17;/h1-9,12-13H,10-11,14-15H2;1H/q+1;/p-1