1-(4-aminophenyl)-2-pyridin-1-ium-1-yl-ethanone chloride

Systemtic Name: 1-(4-aminophenyl)-2-pyridin-1-ium-1-yl-ethanone chloride Openeye Name: 1-(4-aminophenyl)-2-pyridin-1-ium-1-yl-ethanone chloride CAS Name: 1-(4-aminophenyl)-2-(1-pyridin-1-iumyl)ethanone chloride IUPAC Name: 1-(4-aminophenyl)-2-pyridin-1-ium-1-ylethanone chloride Traditional Name: 1-(4-aminophenyl)-2-pyridin-1-ium-1-yl-ethanone chloride Formula: C13H13ClN2O MolecularWeight: 248.70812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)N.[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)N.[Cl-]

InChI

InChI=1S/C13H12N2O.ClH/c14-12-6-4-11(5-7-12)13(16)10-15-8-2-1-3-9-15;/h1-9H,10H2,(H-,14,16);1H