2-[8-fluoranyl-2-(trifluoromethyl)quinolin-4-yl]sulfanylethylazanium

Systemtic Name: 2-[8-fluoranyl-2-(trifluoromethyl)quinolin-4-yl]sulfanylethylazanium Openeye Name: 2-[[8-fluoro-2-(trifluoromethyl)-4-quinolyl]sulfanyl]ethylammonium CAS Name: 2-[[8-fluoro-2-(trifluoromethyl)-4-quinolinyl]thio]ethylammonium IUPAC Name: 2-[8-fluoro-2-(trifluoromethyl)quinolin-4-yl]sulfanylethylazanium Traditional Name: 2-[[8-fluoro-2-(trifluoromethyl)-4-quinolyl]thio]ethylammonium Formula: C12H11F4N2S+ MolecularWeight: 291.287753

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)F)N=C(C=C2SCC[NH3+])C(F)(F)F

Isomeric SMILES

C1=CC2=C(C(=C1)F)N=C(C=C2SCC[NH3+])C(F)(F)F

InChI

InChI=1S/C12H10F4N2S/c13-8-3-1-2-7-9(19-5-4-17)6-10(12(14,15)16)18-11(7)8/h1-3,6H,4-5,17H2/p+1