6-fluoranyl-1-(5-fluoranylpyridin-2-yl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride

Systemtic Name: 6-fluoranyl-1-(5-fluoranylpyridin-2-yl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid hydrochloride Openeye Name: 6-fluoro-1-(5-fluoro-2-pyridyl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid hydrochloride CAS Name: 6-fluoro-1-(5-fluoro-2-pyridinyl)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid hydrochloride IUPAC Name: 6-fluoro-1-(5-fluoropyridin-2-yl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid hydrochloride Traditional Name: 6-fluoro-1-(5-fluoro-2-pyridyl)-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid hydrochloride Formula: C20H19ClF2N4O3 MolecularWeight: 436.839666

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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)C4=NC=C(C=C4)F)F.Cl

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=NC=C(C=C4)F)F.Cl

InChI

InChI=1S/C20H18F2N4O3.ClH/c1-24-4-6-25(7-5-24)17-9-16-13(8-15(17)22)19(27)14(20(28)29)11-26(16)18-3-2-12(21)10-23-18;/h2-3,8-11H,4-7H2,1H3,(H,28,29);1H