N'-(1H-pyrrol-2-ylcarbonyl)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carbohydrazide

Systemtic Name: N'-(1H-pyrrol-2-ylcarbonyl)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carbohydrazide Openeye Name: N'-(1H-pyrrole-2-carbonyl)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carbohydrazide CAS Name: N'-[oxo(1H-pyrrol-2-yl)methyl]-1-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-piperidinecarbohydrazide IUPAC Name: N'-(1H-pyrrole-2-carbonyl)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carbohydrazide Traditional Name: N'-(1H-pyrrole-2-carbonyl)-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]isonipecotohydrazide Formula: C17H19F3N5O2+ MolecularWeight: 382.36027

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NNC(=O)C2=CC=CN2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C(=O)NNC(=O)C2=CC=CN2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H18F3N5O2/c18-17(19,20)12-3-4-14(22-10-12)25-8-5-11(6-9-25)15(26)23-24-16(27)13-2-1-7-21-13/h1-4,7,10-11,21H,5-6,8-9H2,(H,23,26)(H,24,27)/p+1