2-[(2R,6S)-1-[2-(1,3-dimethylimidazol-1-ium-4-yl)ethyl]-6-(3-methylpyridin-2-yl)piperidin-2-yl]-3-methyl-pyridine iodide

Systemtic Name: 2-[(2R,6S)-1-[2-(1,3-dimethylimidazol-1-ium-4-yl)ethyl]-6-(3-methylpyridin-2-yl)piperidin-2-yl]-3-methyl-pyridine iodide Openeye Name: 2-[(2R,6S)-1-[2-(1,3-dimethylimidazol-1-ium-4-yl)ethyl]-6-(3-methyl-2-pyridyl)-2-piperidyl]-3-methyl-pyridine iodide CAS Name: 2-[(2R,6S)-1-[2-(1,3-dimethyl-4-imidazol-1-iumyl)ethyl]-6-(3-methyl-2-pyridinyl)-2-piperidinyl]-3-methylpyridine iodide IUPAC Name: 2-[(2R,6S)-1-[2-(1,3-dimethylimidazol-1-ium-4-yl)ethyl]-6-(3-methylpyridin-2-yl)piperidin-2-yl]-3-methylpyridine iodide Traditional Name: 2-[(2R,6S)-1-[2-(1,3-dimethylimidazol-1-ium-4-yl)ethyl]-6-(3-methyl-2-pyridyl)-2-piperidyl]-3-methyl-pyridine iodide Formula: C24H32IN5 MolecularWeight: 517.44885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C2CCCC(N2CCC3=C[N+](=CN3C)C)C4=C(C=CC=N4)C.[I-]

Isomeric SMILES

CC1=C(N=CC=C1)[C@H]2CCC[C@H](N2CCC3=C[N+](=CN3C)C)C4=C(C=CC=N4)C.[I-]

InChI

InChI=1S/C24H32N5.HI/c1-18-8-6-13-25-23(18)21-10-5-11-22(24-19(2)9-7-14-26-24)29(21)15-12-20-16-27(3)17-28(20)4;/h6-9,13-14,16-17,21-22H,5,10-12,15H2,1-4H3;1H/q+1;/p-1/t21-,22+;