2-(2-methylpyridin-1-ium-1-yl)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone chloride

Systemtic Name: 2-(2-methylpyridin-1-ium-1-yl)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone chloride Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(2-methylpyridin-1-ium-1-yl)ethanone chloride CAS Name: 2-(2-methyl-1-pyridin-1-iumyl)-1-[4-(phenylmethyl)-1-piperidinyl]ethanone chloride IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(2-methylpyridin-1-ium-1-yl)ethanone chloride Traditional Name: 1-(4-benzylpiperidino)-2-(2-methylpyridin-1-ium-1-yl)ethanone chloride Formula: C20H25ClN2O MolecularWeight: 344.8783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CC(=O)N2CCC(CC2)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC1=CC=CC=[N+]1CC(=O)N2CCC(CC2)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H25N2O.ClH/c1-17-7-5-6-12-22(17)16-20(23)21-13-10-19(11-14-21)15-18-8-3-2-4-9-18;/h2-9,12,19H,10-11,13-16H2,1H3;1H/q+1;/p-1