8-chloranyl-1-cyclopropyl-8-[3-(3,4-dimethoxyphenyl)piperazin-1-yl]-6-fluoranyl-4-oxidanylidene-5H-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-1-cyclopropyl-8-[3-(3,4-dimethoxyphenyl)piperazin-1-yl]-6-fluoranyl-4-oxidanylidene-5H-quinoline-3-carboxylic acid Openeye Name: 8-chloro-1-cyclopropyl-8-[3-(3,4-dimethoxyphenyl)piperazin-1-yl]-6-fluoro-4-oxo-5H-quinoline-3-carboxylic acid CAS Name: 8-chloro-1-cyclopropyl-8-[3-(3,4-dimethoxyphenyl)-1-piperazinyl]-6-fluoro-4-oxo-5H-quinoline-3-carboxylic acid IUPAC Name: 8-chloro-1-cyclopropyl-8-[3-(3,4-dimethoxyphenyl)piperazin-1-yl]-6-fluoro-4-oxo-5H-quinoline-3-carboxylic acid Traditional Name: 8-chloro-1-cyclopropyl-8-[3-(3,4-dimethoxyphenyl)piperazino]-6-fluoro-4-keto-5H-quinoline-3-carboxylic acid Formula: C25H27ClFN3O5 MolecularWeight: 503.950383

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CN(CCN2)C3(C=C(CC4=C3N(C=C(C4=O)C(=O)O)C5CC5)F)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CN(CCN2)C3(C=C(CC4=C3N(C=C(C4=O)C(=O)O)C5CC5)F)Cl)OC

InChI

InChI=1S/C25H27ClFN3O5/c1-34-20-6-3-14(9-21(20)35-2)19-13-29(8-7-28-19)25(26)11-15(27)10-17-22(31)18(24(32)33)12-30(23(17)25)16-4-5-16/h3,6,9,11-12,16,19,28H,4-5,7-8,10,13H2,1-2H3,(H,32,33)