2-[7-bromanyl-1-(3-ethoxypropyl)-2-methyl-imidazo[4,5-c]pyridin-5-ium-5-yl]-1-naphthalen-2-yl-ethanone bromide

Systemtic Name: 2-[7-bromanyl-1-(3-ethoxypropyl)-2-methyl-imidazo[4,5-c]pyridin-5-ium-5-yl]-1-naphthalen-2-yl-ethanone bromide Openeye Name: 2-[7-bromo-1-(3-ethoxypropyl)-2-methyl-imidazo[4,5-c]pyridin-5-ium-5-yl]-1-(2-naphthyl)ethanone bromide CAS Name: 2-[7-bromo-1-(3-ethoxypropyl)-2-methyl-5-imidazo[4,5-c]pyridin-5-iumyl]-1-(2-naphthalenyl)ethanone bromide IUPAC Name: 2-[7-bromo-1-(3-ethoxypropyl)-2-methylimidazo[4,5-c]pyridin-5-ium-5-yl]-1-naphthalen-2-ylethanone bromide Traditional Name: 2-[7-bromo-1-(3-ethoxypropyl)-2-methyl-imidazo[4,5-c]pyridin-5-ium-5-yl]-1-(2-naphthyl)ethanone bromide Formula: C24H25Br2N3O2 MolecularWeight: 547.2822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=NC2=C[N+](=CC(=C21)Br)CC(=O)C3=CC4=CC=CC=C4C=C3)C.[Br-]

Isomeric SMILES

CCOCCCN1C(=NC2=C[N+](=CC(=C21)Br)CC(=O)C3=CC4=CC=CC=C4C=C3)C.[Br-]

InChI

InChI=1S/C24H25BrN3O2.BrH/c1-3-30-12-6-11-28-17(2)26-22-15-27(14-21(25)24(22)28)16-23(29)20-10-9-18-7-4-5-8-19(18)13-20;/h4-5,7-10,13-15H,3,6,11-12,16H2,1-2H3;1H/q+1;/p-1