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

Systemtic Name: 2-(2-methyl-1-phenethyl-8-phenylmethoxy-imidazo[1,2-a]pyridin-4-ium-3-yl)ethanenitrile bromide Openeye Name: 2-(8-benzyloxy-2-methyl-1-phenethyl-imidazo[1,2-a]pyridin-4-ium-3-yl)acetonitrile bromide CAS Name: 2-(2-methyl-1-phenethyl-8-phenylmethoxy-3-imidazo[1,2-a]pyridin-4-iumyl)acetonitrile bromide IUPAC Name: 2-(2-methyl-1-phenethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-4-ium-3-yl)acetonitrile bromide Traditional Name: 2-(8-benzoxy-2-methyl-1-phenethyl-imidazo[1,2-a]pyridin-4-ium-3-yl)acetonitrile bromide Formula: C25H24BrN3O MolecularWeight: 462.38156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+]2=CC=CC(=C2N1CCC3=CC=CC=C3)OCC4=CC=CC=C4)CC#N.[Br-]

Isomeric SMILES

CC1=C([N+]2=CC=CC(=C2N1CCC3=CC=CC=C3)OCC4=CC=CC=C4)CC#N.[Br-]

InChI

InChI=1S/C25H24N3O.BrH/c1-20-23(14-16-26)28-17-8-13-24(29-19-22-11-6-3-7-12-22)25(28)27(20)18-15-21-9-4-2-5-10-21;/h2-13,17H,14-15,18-19H2,1H3;1H/q+1;/p-1