6-fluoranyl-1-(4-fluorophenyl)-4-oxidanylidene-7-(4-phenylmethoxycarbonylpiperazin-1-yl)quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-1-(4-fluorophenyl)-4-oxidanylidene-7-(4-phenylmethoxycarbonylpiperazin-1-yl)quinoline-3-carboxylic acid Openeye Name: 7-(4-benzyloxycarbonylpiperazin-1-yl)-6-fluoro-1-(4-fluorophenyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-(4-phenylmethoxycarbonyl-1-piperazinyl)-3-quinolinecarboxylic acid IUPAC Name: 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-(4-phenylmethoxycarbonylpiperazin-1-yl)quinoline-3-carboxylic acid Traditional Name: 7-(4-carbobenzoxypiperazino)-6-fluoro-1-(4-fluorophenyl)-4-keto-quinoline-3-carboxylic acid Formula: C28H23F2N3O5 MolecularWeight: 519.496126

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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)F)F)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C28H23F2N3O5/c29-19-6-8-20(9-7-19)33-16-22(27(35)36)26(34)21-14-23(30)25(15-24(21)33)31-10-12-32(13-11-31)28(37)38-17-18-4-2-1-3-5-18/h1-9,14-16H,10-13,17H2,(H,35,36)