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

Systemtic Name: 5-azanyl-1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-isoindolin-5-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-(2,3-dihydro-1H-isoindol-5-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-isoindolin-5-yl-4-keto-quinoline-3-carboxylic acid Formula: C21H17F2N3O3 MolecularWeight: 397.374786

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C2C(=C(C(=C3N)F)C4=CC5=C(CNC5)C=C4)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C2C(=C(C(=C3N)F)C4=CC5=C(CNC5)C=C4)F)C(=O)O

InChI

InChI=1S/C21H17F2N3O3/c22-16-14(9-1-2-10-6-25-7-11(10)5-9)17(23)19-15(18(16)24)20(27)13(21(28)29)8-26(19)12-3-4-12/h1-2,5,8,12,25H,3-4,6-7,24H2,(H,28,29)