1-methyl-3-octadecyl-4,5-dihydroimidazol-1-ium bromide

Systemtic Name: 1-methyl-3-octadecyl-4,5-dihydroimidazol-1-ium bromide Openeye Name: 1-methyl-3-octadecyl-4,5-dihydroimidazol-1-ium bromide CAS Name: 1-methyl-3-octadecyl-4,5-dihydroimidazol-1-ium bromide IUPAC Name: 1-methyl-3-octadecyl-4,5-dihydroimidazol-1-ium bromide Traditional Name: 1-methyl-3-stearyl-2-imidazolin-1-ium bromide Formula: C22H45BrN2 MolecularWeight: 417.5101

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN1CC[N+](=C1)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN1CC[N+](=C1)C.[Br-]

InChI

InChI=1S/C22H45N2.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-21-20-23(2)22-24;/h22H,3-21H2,1-2H3;1H/q+1;/p-1