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

Systemtic Name: propan-2-yl 6,7-bis(fluoranyl)-2-(2-fluoranylethylsulfanyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: isopropyl 6,7-difluoro-2-(2-fluoroethylsulfanyl)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6,7-difluoro-2-(2-fluoroethylthio)-4-oxo-1H-quinoline-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 6,7-difluoro-2-(2-fluoroethylsulfanyl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6,7-difluoro-2-(2-fluoroethylthio)-4-keto-1H-quinoline-3-carboxylic acid isopropyl ester Formula: C15H14F3NO3S MolecularWeight: 345.33677

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)F)SCCF

Isomeric SMILES

CC(C)OC(=O)C1=C(NC2=CC(=C(C=C2C1=O)F)F)SCCF

InChI

InChI=1S/C15H14F3NO3S/c1-7(2)22-15(21)12-13(20)8-5-9(17)10(18)6-11(8)19-14(12)23-4-3-16/h5-7H,3-4H2,1-2H3,(H,19,20)