2-(2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-7-ium-7-yl)-1-(4-phenylphenyl)ethanone bromide

Systemtic Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-7-ium-7-yl)-1-(4-phenylphenyl)ethanone bromide Openeye Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-7-ium-7-yl)-1-(4-phenylphenyl)ethanone bromide CAS Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-7-ium-7-yl)-1-(4-phenylphenyl)ethanone bromide IUPAC Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-7-ium-7-yl)-1-(4-phenylphenyl)ethanone bromide Traditional Name: 2-(2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-7-ium-7-yl)-1-(4-phenylphenyl)ethanone bromide Formula: C21H19BrN2O MolecularWeight: 395.29236

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC2=C1C=CC=[N+]2CC(=O)C3=CC=C(C=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1CNC2=C1C=CC=[N+]2CC(=O)C3=CC=C(C=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C21H18N2O.BrH/c24-20(15-23-14-4-7-19-12-13-22-21(19)23)18-10-8-17(9-11-18)16-5-2-1-3-6-16;/h1-11,14H,12-13,15H2;1H