1-cyclopropyl-6-fluoranyl-7-[4-[1-methoxy-1,3-bis(oxidanylidene)butan-2-yl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[1-methoxy-1,3-bis(oxidanylidene)butan-2-yl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-(1-methoxycarbonyl-2-oxo-propyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-(1-methoxy-1,3-dioxobutan-2-yl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-(1-methoxy-1,3-dioxobutan-2-yl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-(1-carbomethoxy-2-keto-propyl)piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H24FN3O6 MolecularWeight: 445.440863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)OC)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CC(=O)C(C(=O)OC)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C22H24FN3O6/c1-12(27)19(22(31)32-2)25-7-5-24(6-8-25)18-10-17-14(9-16(18)23)20(28)15(21(29)30)11-26(17)13-3-4-13/h9-11,13,19H,3-8H2,1-2H3,(H,29,30)