1-cyclopropyl-6-fluoranyl-7-(4-nitro-1,3-dihydroisoindol-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-(4-nitro-1,3-dihydroisoindol-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-(4-nitroisoindolin-2-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-(4-nitro-1,3-dihydroisoindol-2-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-(4-nitro-1,3-dihydroisoindol-2-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-(4-nitroisoindolin-2-yl)quinoline-3-carboxylic acid Formula: C21H16FN3O5 MolecularWeight: 409.367243

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CC5=C(C4)C(=CC=C5)[N+](=O)[O-])F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CC5=C(C4)C(=CC=C5)[N+](=O)[O-])F)C(=O)O

InChI

InChI=1S/C21H16FN3O5/c22-16-6-13-18(24(12-4-5-12)10-15(20(13)26)21(27)28)7-19(16)23-8-11-2-1-3-17(25(29)30)14(11)9-23/h1-3,6-7,10,12H,4-5,8-9H2,(H,27,28)