5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-7-(4-methoxycarbonyl-1,3-dihydroisoindol-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-7-(4-methoxycarbonyl-1,3-dihydroisoindol-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-(4-methoxycarbonylisoindolin-2-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-(4-methoxycarbonyl-1,3-dihydroisoindol-2-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-(4-methoxycarbonyl-1,3-dihydroisoindol-2-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-(4-carbomethoxyisoindolin-2-yl)-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C23H19F2N3O5 MolecularWeight: 455.410866

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2CN(CC2=CC=C1)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)F

Isomeric SMILES

COC(=O)C1=C2CN(CC2=CC=C1)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)F

InChI

InChI=1S/C23H19F2N3O5/c1-33-23(32)12-4-2-3-10-7-27(8-13(10)12)20-16(24)18(26)15-19(17(20)25)28(11-5-6-11)9-14(21(15)29)22(30)31/h2-4,9,11H,5-8,26H2,1H3,(H,30,31)