6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-(trifluoromethyl)quinoline-3-carboxylic acid chloride

Systemtic Name: 6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-(trifluoromethyl)quinoline-3-carboxylic acid chloride Openeye Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-(trifluoromethyl)quinoline-3-carboxylic acid chloride CAS Name: 6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-1-(trifluoromethyl)-3-quinolinecarboxylic acid chloride IUPAC Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-(trifluoromethyl)quinoline-3-carboxylic acid chloride Traditional Name: 6-fluoro-4-keto-7-(4-methylpiperazino)-1-(trifluoromethyl)quinoline-3-carboxylic acid chloride Formula: C16H15ClF4N3O3- MolecularWeight: 408.755213

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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)C(F)(F)F)F.[Cl-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C(F)(F)F)F.[Cl-]

InChI

InChI=1S/C16H15F4N3O3.ClH/c1-21-2-4-22(5-3-21)13-7-12-9(6-11(13)17)14(24)10(15(25)26)8-23(12)16(18,19)20;/h6-8H,2-5H2,1H3,(H,25,26);1H/p-1