6,7-bis(fluoranyl)-4-oxidanylidene-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylate

Systemtic Name: 6,7-bis(fluoranyl)-4-oxidanylidene-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylate Openeye Name: 6,7-difluoro-4-oxo-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylate CAS Name: 6,7-difluoro-4-oxo-1-(1,2,4-triazol-4-yl)-3-quinolinecarboxylate IUPAC Name: 6,7-difluoro-4-oxo-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylate Traditional Name: 6,7-difluoro-4-keto-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylate Formula: C12H5F2N4O3- MolecularWeight: 291.189906

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=CC(=C1F)F)N(C=C(C2=O)C(=O)[O-])N3C=NN=C3

Isomeric SMILES

C1=C2C(=CC(=C1F)F)N(C=C(C2=O)C(=O)[O-])N3C=NN=C3

InChI

InChI=1S/C12H6F2N4O3/c13-8-1-6-10(2-9(8)14)18(17-4-15-16-5-17)3-7(11(6)19)12(20)21/h1-5H,(H,20,21)/p-1