1-cyclopropyl-7-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-(5,7-dihydropyrrolo[3,4-b]pyridin-6-yl)-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H16FN3O3 MolecularWeight: 365.357743

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CC5=C(C4)N=CC=C5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CC5=C(C4)N=CC=C5)F)C(=O)O

InChI

InChI=1S/C20H16FN3O3/c21-15-6-13-17(24(12-3-4-12)9-14(19(13)25)20(26)27)7-18(15)23-8-11-2-1-5-22-16(11)10-23/h1-2,5-7,9,12H,3-4,8,10H2,(H,26,27)