pyridin-2-ylazanium; 3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoate

Systemtic Name: pyridin-2-ylazanium; 3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoate Openeye Name: 2-pyridylammonium; 3,3,3-trifluoro-2-(trifluoromethyl)propanoate CAS Name: 2-pyridinylammonium; 3,3,3-trifluoro-2-(trifluoromethyl)propanoate IUPAC Name: pyridin-2-ylazanium; 3,3,3-trifluoro-2-(trifluoromethyl)propanoate Traditional Name: 2-pyridylammonium; 3,3,3-trifluoro-2-(trifluoromethyl)propionate Formula: C9H8F6N2O2 MolecularWeight: 290.162439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)[NH3+].C(C(=O)[O-])(C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC=NC(=C1)[NH3+].C(C(=O)[O-])(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C5H6N2.C4H2F6O2/c6-5-3-1-2-4-7-5;5-3(6,7)1(2(11)12)4(8,9)10/h1-4H,(H2,6,7);1H,(H,11,12)