2-azanyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-5-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid

Systemtic Name: 2-azanyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-5-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid Openeye Name: 2-amino-1-cyclopropyl-6-fluoro-4-oxo-5-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid CAS Name: 2-amino-1-cyclopropyl-6-fluoro-4-oxo-5-(trifluoromethylsulfonyl)-3-quinolinecarboxylic acid IUPAC Name: 2-amino-1-cyclopropyl-6-fluoro-4-oxo-5-(trifluoromethylsulfonyl)quinoline-3-carboxylic acid Traditional Name: 2-amino-1-cyclopropyl-6-fluoro-4-keto-5-triflyl-quinoline-3-carboxylic acid Formula: C14H10F4N2O5S MolecularWeight: 394.298213

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C(=C(C=C3)F)S(=O)(=O)C(F)(F)F)C(=O)C(=C2N)C(=O)O

Isomeric SMILES

C1CC1N2C3=C(C(=C(C=C3)F)S(=O)(=O)C(F)(F)F)C(=O)C(=C2N)C(=O)O

InChI

InChI=1S/C14H10F4N2O5S/c15-6-3-4-7-8(11(6)26(24,25)14(16,17)18)10(21)9(13(22)23)12(19)20(7)5-1-2-5/h3-5H,1-2,19H2,(H,22,23)