1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(1-methylpiperidin-1-ium-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]-N-(1-methylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Openeye Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methylpiperidin-1-ium-4-yl)piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(1-methyl-4-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-N-(1-methylpiperidin-1-ium-4-yl)piperidine-4-carboxamide Traditional Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-N-(1-methylpiperidin-1-ium-4-yl)isonipecotamide Formula: C18H25ClF3N4O+ MolecularWeight: 405.86551

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)C2CCN(CC2)C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C18H24ClF3N4O/c1-25-6-4-14(5-7-25)24-17(27)12-2-8-26(9-3-12)16-15(19)10-13(11-23-16)18(20,21)22/h10-12,14H,2-9H2,1H3,(H,24,27)/p+1