6-fluoranyl-4-oxidanylidene-7-(4-oxidanylpiperazin-1-yl)-1-(4-phosphonooxyphenyl)quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-7-(4-oxidanylpiperazin-1-yl)-1-(4-phosphonooxyphenyl)quinoline-3-carboxylic acid Openeye Name: 6-fluoro-7-(4-hydroxypiperazin-1-yl)-4-oxo-1-(4-phosphonooxyphenyl)quinoline-3-carboxylic acid CAS Name: 6-fluoro-7-(4-hydroxy-1-piperazinyl)-4-oxo-1-(4-phosphonooxyphenyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-7-(4-hydroxypiperazin-1-yl)-4-oxo-1-(4-phosphonooxyphenyl)quinoline-3-carboxylic acid Traditional Name: 6-fluoro-7-(4-hydroxypiperazino)-4-keto-1-(4-phosphonooxyphenyl)quinoline-3-carboxylic acid Formula: C20H19FN3O8P MolecularWeight: 479.352324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)OP(=O)(O)O)F)O

Isomeric SMILES

C1CN(CCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)OP(=O)(O)O)F)O

InChI

InChI=1S/C20H19FN3O8P/c21-16-9-14-17(10-18(16)22-5-7-23(28)8-6-22)24(11-15(19(14)25)20(26)27)12-1-3-13(4-2-12)32-33(29,30)31/h1-4,9-11,28H,5-8H2,(H,26,27)(H2,29,30,31)