ethyl 5,6-bis(fluoranyl)-2-(methoxymethylsulfanyl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 5,6-bis(fluoranyl)-2-(methoxymethylsulfanyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 5,6-difluoro-2-(methoxymethylsulfanyl)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 5,6-difluoro-2-(methoxymethylthio)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5,6-difluoro-2-(methoxymethylsulfanyl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 5,6-difluoro-4-keto-2-(methoxymethylthio)-1H-quinoline-3-carboxylic acid ethyl ester Formula: C14H13F2NO4S MolecularWeight: 329.319126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1=O)C(=C(C=C2)F)F)SCOC

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1=O)C(=C(C=C2)F)F)SCOC

InChI

InChI=1S/C14H13F2NO4S/c1-3-21-14(19)10-12(18)9-8(5-4-7(15)11(9)16)17-13(10)22-6-20-2/h4-5H,3,6H2,1-2H3,(H,17,18)