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

Systemtic Name: 6-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-1-quinolin-6-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-(6-quinolyl)quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-1-(6-quinolinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1-quinolin-6-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-(4-methylpiperazino)-1-(6-quinolyl)quinoline-3-carboxylic acid Formula: C24H21FN4O3 MolecularWeight: 432.446943

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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=CC5=C(C=C4)N=CC=C5)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC5=C(C=C4)N=CC=C5)F

InChI

InChI=1S/C24H21FN4O3/c1-27-7-9-28(10-8-27)22-13-21-17(12-19(22)25)23(30)18(24(31)32)14-29(21)16-4-5-20-15(11-16)3-2-6-26-20/h2-6,11-14H,7-10H2,1H3,(H,31,32)