1-ethyl-6-fluoranyl-4-oxidanylidene-7-(4-quinolin-2-ylcarbonylpiperazin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-4-oxidanylidene-7-(4-quinolin-2-ylcarbonylpiperazin-1-yl)quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(quinoline-2-carbonyl)piperazin-1-yl]quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[4-[oxo(2-quinolinyl)methyl]-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7-[4-(quinoline-2-carbonyl)piperazin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-4-keto-7-(4-quinaldoylpiperazino)quinoline-3-carboxylic acid Formula: C26H23FN4O4 MolecularWeight: 474.483623

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=NC5=CC=CC=C5C=C4)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=NC5=CC=CC=C5C=C4)F)C(=O)O

InChI

InChI=1S/C26H23FN4O4/c1-2-29-15-18(26(34)35)24(32)17-13-19(27)23(14-22(17)29)30-9-11-31(12-10-30)25(33)21-8-7-16-5-3-4-6-20(16)28-21/h3-8,13-15H,2,9-12H2,1H3,(H,34,35)