1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-(5-oxidanyl-5-oxidanylidene-pentanoyl)piperazin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-(5-oxidanyl-5-oxidanylidene-pentanoyl)piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-(5-hydroxy-5-oxo-pentanoyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-(5-hydroxy-1,5-dioxopentyl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-(5-hydroxy-5-oxopentanoyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[4-(5-hydroxy-5-keto-pentanoyl)piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C22H24FN3O6 MolecularWeight: 445.440863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)CCCC(=O)O)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)CCCC(=O)O)F)C(=O)O

InChI

InChI=1S/C22H24FN3O6/c23-16-10-14-17(26(13-4-5-13)12-15(21(14)30)22(31)32)11-18(16)24-6-8-25(9-7-24)19(27)2-1-3-20(28)29/h10-13H,1-9H2,(H,28,29)(H,31,32)