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

Systemtic Name: ethyl 6,7,8-tris(fluoranyl)-1-(3-methyl-1,2-thiazol-5-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6,7,8-trifluoro-1-(3-methylisothiazol-5-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 6,7,8-trifluoro-1-(3-methyl-5-isothiazolyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7,8-trifluoro-1-(3-methyl-1,2-thiazol-5-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 6,7,8-trifluoro-4-keto-1-(3-methylisothiazol-5-yl)quinoline-3-carboxylic acid ethyl ester Formula: C16H11F3N2O3S MolecularWeight: 368.33035

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)F)C3=CC(=NS3)C

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)F)C3=CC(=NS3)C

InChI

InChI=1S/C16H11F3N2O3S/c1-3-24-16(23)9-6-21(11-4-7(2)20-25-11)14-8(15(9)22)5-10(17)12(18)13(14)19/h4-6H,3H2,1-2H3