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

Systemtic Name: 1-[5-chloranyl-3-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide Openeye Name: 1-[5-chloro-3-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide CAS Name: 1-[5-chloro-3-(trifluoromethyl)-2-pyridin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: 1-[5-chloro-3-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide Traditional Name: 1-[5-chloro-3-(trifluoromethyl)pyridin-1-ium-2-yl]isonipecotamide Formula: C12H14ClF3N3O+ MolecularWeight: 308.70727

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N)C2=[NH+]C=C(C=C2C(F)(F)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N)C2=[NH+]C=C(C=C2C(F)(F)F)Cl

InChI

InChI=1S/C12H13ClF3N3O/c13-8-5-9(12(14,15)16)11(18-6-8)19-3-1-7(2-4-19)10(17)20/h5-7H,1-4H2,(H2,17,20)/p+1