1-(2-fluoranylethyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(2-fluoranylethyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(2-fluoroethyl)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(2-fluoroethyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2-fluoroethyl)-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid Formula: C17H20FN3O3 MolecularWeight: 333.357403

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C2)C(=O)C(=CN3CCF)C(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)C(=O)C(=CN3CCF)C(=O)O

InChI

InChI=1S/C17H20FN3O3/c1-19-6-8-20(9-7-19)12-2-3-13-15(10-12)21(5-4-18)11-14(16(13)22)17(23)24/h2-3,10-11H,4-9H2,1H3,(H,23,24)