bis(fluoranyl)boranyl 7-ethoxy-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: bis(fluoranyl)boranyl 7-ethoxy-1-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: difluoroboranyl 7-ethoxy-1-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylate CAS Name: 7-ethoxy-1-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid difluoroboranyl ester IUPAC Name: difluoroboranyl 7-ethoxy-1-ethyl-6-fluoro-4-oxoquinoline-3-carboxylate Traditional Name: 7-ethoxy-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid difluoroboranyl ester Formula: C14H13BF3NO4 MolecularWeight: 327.06353

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Descriptors Computed from Structure

Canonical SMILES:

B(OC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)OCC)CC)(F)F

Isomeric SMILES

B(OC(=O)C1=CN(C2=CC(=C(C=C2C1=O)F)OCC)CC)(F)F

InChI

InChI=1S/C14H13BF3NO4/c1-3-19-7-9(14(21)23-15(17)18)13(20)8-5-10(16)12(22-4-2)6-11(8)19/h5-7H,3-4H2,1-2H3