1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(trifluoromethylsulfonyl)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-triflyl-quinoline-3-carboxylic acid Formula: C14H9F4NO5S MolecularWeight: 379.283573

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)S(=O)(=O)C(F)(F)F)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)S(=O)(=O)C(F)(F)F)F)C(=O)O

InChI

InChI=1S/C14H9F4NO5S/c15-9-3-7-10(4-11(9)25(23,24)14(16,17)18)19(6-1-2-6)5-8(12(7)20)13(21)22/h3-6H,1-2H2,(H,21,22)