8-[bis(fluoranyl)methoxy]-1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-[bis(fluoranyl)methoxy]-1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-8-(difluoromethoxy)-7-isoindolin-5-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-8-(difluoromethoxy)-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-8-(difluoromethoxy)-7-(2,3-dihydro-1H-isoindol-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-8-(difluoromethoxy)-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C22H18F2N2O4 MolecularWeight: 412.386126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C2C(=C(C=C3)C4=CC5=C(CNC5)C=C4)OC(F)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C2C(=C(C=C3)C4=CC5=C(CNC5)C=C4)OC(F)F)C(=O)O

InChI

InChI=1S/C22H18F2N2O4/c23-22(24)30-20-15(11-1-2-12-8-25-9-13(12)7-11)5-6-16-18(20)26(14-3-4-14)10-17(19(16)27)21(28)29/h1-2,5-7,10,14,22,25H,3-4,8-9H2,(H,28,29)