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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-(propoxycarbonylcarbamoyl)piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-(propoxycarbonylcarbamoyl)piperazin-1-yl]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[oxo-[[oxo(propoxy)methyl]amino]methyl]-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-(propoxycarbonylcarbamoyl)piperazin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-(propoxycarbonylcarbamoyl)piperazino]quinoline-3-carboxylic acid Formula: C22H25FN4O6 MolecularWeight: 460.455503

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)NC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCCOC(=O)NC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C22H25FN4O6/c1-2-9-33-22(32)24-21(31)26-7-5-25(6-8-26)18-11-17-14(10-16(18)23)19(28)15(20(29)30)12-27(17)13-3-4-13/h10-13H,2-9H2,1H3,(H,29,30)(H,24,31,32)