ethyl 5,6,7,8-tetrakis(fluoranyl)-4-oxidanylidene-2-sulfanyl-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 5,6,7,8-tetrakis(fluoranyl)-4-oxidanylidene-2-sulfanyl-1H-quinoline-3-carboxylate Openeye Name: ethyl 5,6,7,8-tetrafluoro-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate CAS Name: 5,6,7,8-tetrafluoro-2-mercapto-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5,6,7,8-tetrafluoro-4-oxo-2-sulfanyl-1H-quinoline-3-carboxylate Traditional Name: 5,6,7,8-tetrafluoro-4-keto-2-mercapto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C12H7F4NO3S MolecularWeight: 321.247493

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1=O)C(=C(C(=C2F)F)F)F)S

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1=O)C(=C(C(=C2F)F)F)F)S

InChI

InChI=1S/C12H7F4NO3S/c1-2-20-12(19)4-10(18)3-5(13)6(14)7(15)8(16)9(3)17-11(4)21/h2H2,1H3,(H2,17,18,21)