6-fluoranyl-1-(oxetan-3-yl)-5-oxidanyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(oxetan-3-yl)-5-oxidanyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-5-hydroxy-1-(oxetan-3-yl)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid CAS Name: 6-fluoro-5-hydroxy-1-(3-oxetanyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-5-hydroxy-1-(oxetan-3-yl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid Traditional Name: 6-fluoro-5-hydroxy-4-keto-1-(oxetan-3-yl)-7-piperazino-quinoline-3-carboxylic acid Formula: C17H18FN3O5 MolecularWeight: 363.340323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4COC4)O)F

Isomeric SMILES

C1CN(CCN1)C2=C(C(=C3C(=C2)N(C=C(C3=O)C(=O)O)C4COC4)O)F

InChI

InChI=1S/C17H18FN3O5/c18-14-12(20-3-1-19-2-4-20)5-11-13(16(14)23)15(22)10(17(24)25)6-21(11)9-7-26-8-9/h5-6,9,19,23H,1-4,7-8H2,(H,24,25)