1-cyclopropyl-7-(4-ethyl-3-methyl-piperazin-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-piperazin-1-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-piperazin-1-yl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-1-piperazinyl)-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(4-ethyl-3-methylpiperazin-1-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(4-ethyl-3-methyl-piperazino)-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H24FN3O3 MolecularWeight: 373.421263

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCN1CCN(CC1C)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C20H24FN3O3/c1-3-22-6-7-23(10-12(22)2)18-9-17-14(8-16(18)21)19(25)15(20(26)27)11-24(17)13-4-5-13/h8-9,11-13H,3-7,10H2,1-2H3,(H,26,27)