2-(3-methyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide

Systemtic Name: 2-(3-methyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide Openeye Name: 2-(3-methyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide CAS Name: 2-(3-methyl-2-phenyl-1-imidazo[1,2-a]pyridin-4-iumyl)-1-(3-nitrophenyl)ethanone bromide IUPAC Name: 2-(3-methyl-2-phenylimidazo[1,2-a]pyridin-4-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide Traditional Name: 2-(3-methyl-2-phenyl-imidazo[1,2-a]pyridin-4-ium-1-yl)-1-(3-nitrophenyl)ethanone bromide Formula: C22H18BrN3O3 MolecularWeight: 452.30062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=[N+]12)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=C(N(C2=CC=CC=[N+]12)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C22H18N3O3.BrH/c1-16-22(17-8-3-2-4-9-17)24(21-12-5-6-13-23(16)21)15-20(26)18-10-7-11-19(14-18)25(27)28;/h2-14H,15H2,1H3;1H/q+1;/p-1