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

Systemtic Name: 2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)-N-[2,2,2-tris(fluoranyl)ethylcarbamoyl]ethanamide Openeye Name: 2-[4-(2-pyridyl)piperazin-1-ium-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide CAS Name: N-[oxo-(2,2,2-trifluoroethylamino)methyl]-2-[4-(2-pyridinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-(4-pyridin-2-ylpiperazin-1-ium-1-yl)-N-(2,2,2-trifluoroethylcarbamoyl)acetamide Traditional Name: 2-[4-(2-pyridyl)piperazin-1-ium-1-yl]-N-(2,2,2-trifluoroethylcarbamoyl)acetamide Formula: C14H19F3N5O2+ MolecularWeight: 346.32817

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18F3N5O2/c15-14(16,17)10-19-13(24)20-12(23)9-21-5-7-22(8-6-21)11-3-1-2-4-18-11/h1-4H,5-10H2,(H2,19,20,23,24)/p+1