3-[(2,3-dimethyl-8-phenylmethoxy-imidazo[1,2-a]pyridin-4-ium-1-yl)methyl]benzenecarbonitrile bromide

Systemtic Name: 3-[(2,3-dimethyl-8-phenylmethoxy-imidazo[1,2-a]pyridin-4-ium-1-yl)methyl]benzenecarbonitrile bromide Openeye Name: 3-[(8-benzyloxy-2,3-dimethyl-imidazo[1,2-a]pyridin-4-ium-1-yl)methyl]benzonitrile bromide CAS Name: 3-[(2,3-dimethyl-8-phenylmethoxy-1-imidazo[1,2-a]pyridin-4-iumyl)methyl]benzonitrile bromide IUPAC Name: 3-[(2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-4-ium-1-yl)methyl]benzonitrile bromide Traditional Name: 3-[(8-benzoxy-2,3-dimethyl-imidazo[1,2-a]pyridin-4-ium-1-yl)methyl]benzonitrile bromide Formula: C24H22BrN3O MolecularWeight: 448.35498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+]2=CC=CC(=C2N1CC3=CC=CC(=C3)C#N)OCC4=CC=CC=C4)C.[Br-]

Isomeric SMILES

CC1=C([N+]2=CC=CC(=C2N1CC3=CC=CC(=C3)C#N)OCC4=CC=CC=C4)C.[Br-]

InChI

InChI=1S/C24H22N3O.BrH/c1-18-19(2)27(16-22-11-6-10-21(14-22)15-25)24-23(12-7-13-26(18)24)28-17-20-8-4-3-5-9-20;/h3-14H,16-17H2,1-2H3;1H/q+1;/p-1