ethyl 6,7,8-tris(fluoranyl)-2-(methoxymethylsulfanyl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7,8-tris(fluoranyl)-2-(methoxymethylsulfanyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6,7,8-trifluoro-2-(methoxymethylsulfanyl)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6,7,8-trifluoro-2-(methoxymethylthio)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6,7,8-trifluoro-2-(methoxymethylsulfanyl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6,7,8-trifluoro-4-keto-2-(methoxymethylthio)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C14H12F3NO4S MolecularWeight: 347.30959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C(=C(C=C2C1=O)F)F)F)SCOC

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C(=C(C=C2C1=O)F)F)F)SCOC

InChI

InChI=1S/C14H12F3NO4S/c1-3-22-14(20)8-12(19)6-4-7(15)9(16)10(17)11(6)18-13(8)23-5-21-2/h4H,3,5H2,1-2H3,(H,18,19)