2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(4-phenylphenyl)ethanone chloride

Systemtic Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(4-phenylphenyl)ethanone chloride Openeye Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(4-phenylphenyl)ethanone chloride CAS Name: 2-[4-(dimethylamino)-1-pyridin-1-iumyl]-1-(4-phenylphenyl)ethanone chloride IUPAC Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(4-phenylphenyl)ethanone chloride Traditional Name: 2-[4-(dimethylamino)pyridin-1-ium-1-yl]-1-(4-phenylphenyl)ethanone chloride Formula: C21H21ClN2O MolecularWeight: 352.85724

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C21H21N2O.ClH/c1-22(2)20-12-14-23(15-13-20)16-21(24)19-10-8-18(9-11-19)17-6-4-3-5-7-17;/h3-15H,16H2,1-2H3;1H/q+1;/p-1