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

Systemtic Name: (2,4-dichlorophenyl)-[2-(1-methylpyridin-1-ium-3-yl)piperidin-1-yl]methanone iodide Openeye Name: (2,4-dichlorophenyl)-[2-(1-methylpyridin-1-ium-3-yl)-1-piperidyl]methanone iodide CAS Name: (2,4-dichlorophenyl)-[2-(1-methyl-3-pyridin-1-iumyl)-1-piperidinyl]methanone iodide IUPAC Name: (2,4-dichlorophenyl)-[2-(1-methylpyridin-1-ium-3-yl)piperidin-1-yl]methanone iodide Traditional Name: (2,4-dichlorophenyl)-[2-(1-methylpyridin-1-ium-3-yl)piperidino]methanone iodide Formula: C18H19Cl2IN2O MolecularWeight: 477.16673

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19Cl2N2O.HI/c1-21-9-4-5-13(12-21)17-6-2-3-10-22(17)18(23)15-8-7-14(19)11-16(15)20;/h4-5,7-9,11-12,17H,2-3,6,10H2,1H3;1H/q+1;/p-1