8-chloranyl-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-1-(2-fluoranylcyclopropyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoranyl-1-(2-fluoranylcyclopropyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-chloro-6-fluoro-1-(2-fluorocyclopropyl)-7-isoindolin-5-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-chloro-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluorocyclopropyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-7-(2,3-dihydro-1H-isoindol-5-yl)-6-fluoro-1-(2-fluorocyclopropyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-chloro-6-fluoro-1-(2-fluorocyclopropyl)-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C21H15ClF2N2O3 MolecularWeight: 416.805206

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1F)N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)C4=CC5=C(CNC5)C=C4)F)C(=O)O

Isomeric SMILES

C1C(C1F)N2C=C(C(=O)C3=CC(=C(C(=C32)Cl)C4=CC5=C(CNC5)C=C4)F)C(=O)O

InChI

InChI=1S/C21H15ClF2N2O3/c22-18-17(9-1-2-10-6-25-7-11(10)3-9)15(24)4-12-19(18)26(16-5-14(16)23)8-13(20(12)27)21(28)29/h1-4,8,14,16,25H,5-7H2,(H,28,29)