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

Systemtic Name: ethyl 6,7-bis(fluoranyl)-4-oxidanylidene-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylate Openeye Name: ethyl 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-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 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-carboxylic acid ethyl ester Formula: C14H10F2N4O3 MolecularWeight: 320.251006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)F)N3C=NN=C3

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)F)N3C=NN=C3

InChI

InChI=1S/C14H10F2N4O3/c1-2-23-14(22)9-5-20(19-6-17-18-7-19)12-4-11(16)10(15)3-8(12)13(9)21/h3-7H,2H2,1H3