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

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-(furan-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-(2-furylmethyl)piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-N-(2-furanylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-(furan-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-(2-furfuryl)isonipecotamide Formula: C17H18ClF3N3O2+ MolecularWeight: 388.79193

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CO2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CO2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C17H17ClF3N3O2/c18-14-8-12(17(19,20)21)9-22-15(14)24-5-3-11(4-6-24)16(25)23-10-13-2-1-7-26-13/h1-2,7-9,11H,3-6,10H2,(H,23,25)/p+1