ethyl 6,7,8-tris(fluoranyl)-1-(1-fluoranyl-3-oxidanyl-propan-2-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 6,7,8-tris(fluoranyl)-1-(1-fluoranyl-3-oxidanyl-propan-2-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6,7,8-trifluoro-1-[1-(fluoromethyl)-2-hydroxy-ethyl]-4-oxo-quinoline-3-carboxylate CAS Name: 6,7,8-trifluoro-1-(1-fluoro-3-hydroxypropan-2-yl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7,8-trifluoro-1-(1-fluoro-3-hydroxypropan-2-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 6,7,8-trifluoro-1-[1-(fluoromethyl)-2-hydroxy-ethyl]-4-keto-quinoline-3-carboxylic acid ethyl ester Formula: C15H13F4NO4 MolecularWeight: 347.261633

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)F)C(CO)CF

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)F)C(CO)CF

InChI

InChI=1S/C15H13F4NO4/c1-2-24-15(23)9-5-20(7(4-16)6-21)13-8(14(9)22)3-10(17)11(18)12(13)19/h3,5,7,21H,2,4,6H2,1H3