6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-1-(1,2,4-triazol-4-yl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-(4-methylpiperazino)-1-(1,2,4-triazol-4-yl)quinoline-3-carboxylic acid Formula: C17H17FN6O3 MolecularWeight: 372.353683

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)N4C=NN=C4)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)N4C=NN=C4)F

InChI

InChI=1S/C17H17FN6O3/c1-21-2-4-22(5-3-21)15-7-14-11(6-13(15)18)16(25)12(17(26)27)8-24(14)23-9-19-20-10-23/h6-10H,2-5H2,1H3,(H,26,27)