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

Systemtic Name: ethyl 2-(3-acetyloxy-2-oxidanylidene-propyl)sulfanyl-6,7,8-tris(fluoranyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 2-(3-acetoxy-2-oxo-propyl)sulfanyl-6,7,8-trifluoro-4-oxo-1H-quinoline-3-carboxylate CAS Name: 2-[(3-acetyloxy-2-oxopropyl)thio]-6,7,8-trifluoro-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-acetyloxy-2-oxopropyl)sulfanyl-6,7,8-trifluoro-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 2-[(3-acetoxy-2-keto-propyl)thio]-6,7,8-trifluoro-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C17H14F3NO6S MolecularWeight: 417.35637

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C(=C(C=C2C1=O)F)F)F)SCC(=O)COC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C(=C(C=C2C1=O)F)F)F)SCC(=O)COC(=O)C

InChI

InChI=1S/C17H14F3NO6S/c1-3-26-17(25)11-15(24)9-4-10(18)12(19)13(20)14(9)21-16(11)28-6-8(23)5-27-7(2)22/h4H,3,5-6H2,1-2H3,(H,21,24)