(4-methoxyphenyl)-[2-(1-methylpyridin-1-ium-3-yl)piperidin-1-yl]methanone iodide

Systemtic Name: (4-methoxyphenyl)-[2-(1-methylpyridin-1-ium-3-yl)piperidin-1-yl]methanone iodide Openeye Name: (4-methoxyphenyl)-[2-(1-methylpyridin-1-ium-3-yl)-1-piperidyl]methanone iodide CAS Name: (4-methoxyphenyl)-[2-(1-methyl-3-pyridin-1-iumyl)-1-piperidinyl]methanone iodide IUPAC Name: (4-methoxyphenyl)-[2-(1-methylpyridin-1-ium-3-yl)piperidin-1-yl]methanone iodide Traditional Name: (4-methoxyphenyl)-[2-(1-methylpyridin-1-ium-3-yl)piperidino]methanone iodide Formula: C19H23IN2O2 MolecularWeight: 438.30259

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C2CCCCN2C(=O)C3=CC=C(C=C3)OC.[I-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C2CCCCN2C(=O)C3=CC=C(C=C3)OC.[I-]

InChI

InChI=1S/C19H23N2O2.HI/c1-20-12-5-6-16(14-20)18-7-3-4-13-21(18)19(22)15-8-10-17(23-2)11-9-15;/h5-6,8-12,14,18H,3-4,7,13H2,1-2H3;1H/q+1;/p-1