6,7,8-tris(fluoranyl)-1-(4-methyl-1,2,5-oxadiazol-3-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 6,7,8-tris(fluoranyl)-1-(4-methyl-1,2,5-oxadiazol-3-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: 6,7,8-trifluoro-1-(4-methyl-1,2,5-oxadiazol-3-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 6,7,8-trifluoro-1-(4-methyl-1,2,5-oxadiazol-3-yl)-4-oxo-3-quinolinecarboxylate IUPAC Name: 6,7,8-trifluoro-1-(4-methyl-1,2,5-oxadiazol-3-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 6,7,8-trifluoro-4-keto-1-(4-methylfurazan-3-yl)quinoline-3-carboxylate Formula: C13H5F3N3O4- MolecularWeight: 324.19171

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NON=C1N2C=C(C(=O)C3=CC(=C(C(=C32)F)F)F)C(=O)[O-]

Isomeric SMILES

CC1=NON=C1N2C=C(C(=O)C3=CC(=C(C(=C32)F)F)F)C(=O)[O-]

InChI

InChI=1S/C13H6F3N3O4/c1-4-12(18-23-17-4)19-3-6(13(21)22)11(20)5-2-7(14)8(15)9(16)10(5)19/h2-3H,1H3,(H,21,22)/p-1