3-[bis(oxidanyl)methylidene]-2-(2,2-dimethylpropyl)-6-fluoranyl-isoquinoline-1,4-dione

Systemtic Name: 3-[bis(oxidanyl)methylidene]-2-(2,2-dimethylpropyl)-6-fluoranyl-isoquinoline-1,4-dione Openeye Name: 3-(dihydroxymethylene)-2-(2,2-dimethylpropyl)-6-fluoro-isoquinoline-1,4-dione CAS Name: 3-(dihydroxymethylidene)-2-(2,2-dimethylpropyl)-6-fluoroisoquinoline-1,4-dione IUPAC Name: 3-(dihydroxymethylidene)-2-(2,2-dimethylpropyl)-6-fluoroisoquinoline-1,4-dione Traditional Name: 3-(dihydroxymethylene)-6-fluoro-2-neopentyl-isoquinoline-1,4-quinone Formula: C15H16FNO4 MolecularWeight: 293.290243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C(=C(O)O)C(=O)C2=C(C1=O)C=CC(=C2)F

Isomeric SMILES

CC(C)(C)CN1C(=C(O)O)C(=O)C2=C(C1=O)C=CC(=C2)F

InChI

InChI=1S/C15H16FNO4/c1-15(2,3)7-17-11(14(20)21)12(18)10-6-8(16)4-5-9(10)13(17)19/h4-6,20-21H,7H2,1-3H3