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

Systemtic Name: 2-[7-bromanyl-1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-5-ium-5-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[7-bromo-1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-5-ium-5-yl]-1-phenyl-ethanone bromide CAS Name: 2-[7-bromo-1-(3-ethoxypropyl)-5-imidazo[4,5-c]pyridin-5-iumyl]-1-phenylethanone bromide IUPAC Name: 2-[7-bromo-1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-5-ium-5-yl]-1-phenylethanone bromide Traditional Name: 2-[7-bromo-1-(3-ethoxypropyl)imidazo[4,5-c]pyridin-5-ium-5-yl]-1-phenyl-ethanone bromide Formula: C19H21Br2N3O2 MolecularWeight: 483.19694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN3O2.BrH/c1-2-25-10-6-9-23-14-21-17-12-22(11-16(20)19(17)23)13-18(24)15-7-4-3-5-8-15;/h3-5,7-8,11-12,14H,2,6,9-10,13H2,1H3;1H/q+1;/p-1