7-(4-ethylpiperazin-1-yl)-6-fluoranyl-1-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(4-ethylpiperazin-1-yl)-6-fluoranyl-1-(methylamino)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-ethylpiperazin-1-yl)-6-fluoro-1-(methylamino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-ethyl-1-piperazinyl)-6-fluoro-1-(methylamino)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-ethylpiperazin-1-yl)-6-fluoro-1-(methylamino)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-ethylpiperazino)-6-fluoro-4-keto-1-(methylamino)quinoline-3-carboxylic acid Formula: C17H21FN4O3 MolecularWeight: 348.372043

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)NC)F

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)NC)F

InChI

InChI=1S/C17H21FN4O3/c1-3-20-4-6-21(7-5-20)15-9-14-11(8-13(15)18)16(23)12(17(24)25)10-22(14)19-2/h8-10,19H,3-7H2,1-2H3,(H,24,25)