2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-[4-(2-pyridyl)piperazin-1-ium-1-yl]-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[4-(2-pyridyl)piperazin-1-ium-1-yl]-N-(2,2,2-trifluoroethyl)acetamide Formula: C13H18F3N4O+ MolecularWeight: 303.30343

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCC(F)(F)F)C2=CC=CC=N2

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCC(F)(F)F)C2=CC=CC=N2

InChI

InChI=1S/C13H17F3N4O/c14-13(15,16)10-18-12(21)9-19-5-7-20(8-6-19)11-3-1-2-4-17-11/h1-4H,5-10H2,(H,18,21)/p+1