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

Systemtic Name: 5-azanyl-1-cyclopropyl-7-(1,3-dihydroisoindol-2-yl)-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-isoindolin-2-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-(1,3-dihydroisoindol-2-yl)-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-(1,3-dihydroisoindol-2-yl)-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-isoindolin-2-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)N4CC5=CC=CC=C5C4)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C2C(=C(C(=C3N)F)N4CC5=CC=CC=C5C4)F)C(=O)O

InChI

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