2-[4-(dimethylamino)-6,7,8-tris(fluoranyl)quinolin-1-ium-2-yl]ethanoate

Systemtic Name: 2-[4-(dimethylamino)-6,7,8-tris(fluoranyl)quinolin-1-ium-2-yl]ethanoate Openeye Name: 2-[4-(dimethylamino)-6,7,8-trifluoro-quinolin-1-ium-2-yl]acetate CAS Name: 2-[4-(dimethylamino)-6,7,8-trifluoro-2-quinolin-1-iumyl]acetate IUPAC Name: 2-[4-(dimethylamino)-6,7,8-trifluoroquinolin-1-ium-2-yl]acetate Traditional Name: 2-[4-(dimethylamino)-6,7,8-trifluoro-quinolin-1-ium-2-yl]acetate Formula: C13H11F3N2O2 MolecularWeight: 284.23385

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=[NH+]C2=C(C(=C(C=C12)F)F)F)CC(=O)[O-]

Isomeric SMILES

CN(C)C1=CC(=[NH+]C2=C(C(=C(C=C12)F)F)F)CC(=O)[O-]

InChI

InChI=1S/C13H11F3N2O2/c1-18(2)9-3-6(4-10(19)20)17-13-7(9)5-8(14)11(15)12(13)16/h3,5H,4H2,1-2H3,(H,19,20)