1-(4-methylphenyl)-2-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-(4-methylphenyl)-2-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)ethanone bromide Openeye Name: 2-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)-1-(p-tolyl)ethanone bromide CAS Name: 1-(4-methylphenyl)-2-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)ethanone bromide IUPAC Name: 1-(4-methylphenyl)-2-(3-phenyl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-1-ium-1-yl)ethanone bromide Traditional Name: 2-(3-phenyl-6,7-dihydro-5H-pyrrol[1,2-a]imidazol-1-ium-1-yl)-1-(p-tolyl)ethanone bromide Formula: C21H21BrN2O MolecularWeight: 397.30824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C[N+]2=C3CCCN3C(=C2)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C[N+]2=C3CCCN3C(=C2)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C21H21N2O.BrH/c1-16-9-11-18(12-10-16)20(24)15-22-14-19(17-6-3-2-4-7-17)23-13-5-8-21(22)23;/h2-4,6-7,9-12,14H,5,8,13,15H2,1H3;1H/q+1;/p-1