1-dodecyl-2-phenyl-3-(phenylmethyl)-4,5-dihydro-1H-imidazole-1,3-diium bromide

Systemtic Name: 1-dodecyl-2-phenyl-3-(phenylmethyl)-4,5-dihydro-1H-imidazole-1,3-diium bromide Openeye Name: 3-benzyl-1-dodecyl-2-phenyl-4,5-dihydro-1H-imidazole-1,3-diium bromide CAS Name: 1-dodecyl-2-phenyl-3-(phenylmethyl)-4,5-dihydro-1H-imidazole-1,3-diium bromide IUPAC Name: 3-benzyl-1-dodecyl-2-phenyl-4,5-dihydro-1H-imidazole-1,3-diium bromide Traditional Name: 1-benzyl-3-lauryl-2-phenyl-2-imidazoline-1,3-diium bromide Formula: C28H42BrN2+ MolecularWeight: 486.55048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[NH+]1CC[N+](=C1C2=CC=CC=C2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

CCCCCCCCCCCC[NH+]1CC[N+](=C1C2=CC=CC=C2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C28H41N2.BrH/c1-2-3-4-5-6-7-8-9-10-17-22-29-23-24-30(25-26-18-13-11-14-19-26)28(29)27-20-15-12-16-21-27;/h11-16,18-21H,2-10,17,22-25H2,1H3;1H/q+1;