6-fluoranyl-1-(4-fluorophenyl)-7-[3-(furan-2-yl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(4-fluorophenyl)-7-[3-(furan-2-yl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-1-(4-fluorophenyl)-7-[3-(2-furyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(4-fluorophenyl)-7-[3-(2-furanyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(4-fluorophenyl)-7-[3-(furan-2-yl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-fluoro-1-(4-fluorophenyl)-7-[3-(2-furyl)piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C24H19F2N3O4 MolecularWeight: 451.422166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)C2=CC=CO2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5=CC=C(C=C5)F)F

Isomeric SMILES

C1CN(CC(N1)C2=CC=CO2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5=CC=C(C=C5)F)F

InChI

InChI=1S/C24H19F2N3O4/c25-14-3-5-15(6-4-14)29-12-17(24(31)32)23(30)16-10-18(26)21(11-20(16)29)28-8-7-27-19(13-28)22-2-1-9-33-22/h1-6,9-12,19,27H,7-8,13H2,(H,31,32)