1-butyl-2,3-dimethyl-8-phenylmethoxy-imidazo[1,2-a]pyridin-4-ium bromide

Systemtic Name: 1-butyl-2,3-dimethyl-8-phenylmethoxy-imidazo[1,2-a]pyridin-4-ium bromide Openeye Name: 8-benzyloxy-1-butyl-2,3-dimethyl-imidazo[1,2-a]pyridin-4-ium bromide CAS Name: 1-butyl-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-4-ium bromide IUPAC Name: 1-butyl-2,3-dimethyl-8-phenylmethoxyimidazo[1,2-a]pyridin-4-ium bromide Traditional Name: 8-benzoxy-1-butyl-2,3-dimethyl-imidazo[1,2-a]pyridin-4-ium bromide Formula: C20H25BrN2O MolecularWeight: 389.3293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C([N+]2=CC=CC(=C12)OCC3=CC=CC=C3)C)C.[Br-]

Isomeric SMILES

CCCCN1C(=C([N+]2=CC=CC(=C12)OCC3=CC=CC=C3)C)C.[Br-]

InChI

InChI=1S/C20H25N2O.BrH/c1-4-5-13-21-16(2)17(3)22-14-9-12-19(20(21)22)23-15-18-10-7-6-8-11-18;/h6-12,14H,4-5,13,15H2,1-3H3;1H/q+1;/p-1