3-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-1-oxidanylidene-3H-2-benzofuran-5-carbonitrile

Systemtic Name: 3-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-1-oxidanylidene-3H-2-benzofuran-5-carbonitrile Openeye Name: 3-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-1-oxo-3H-isobenzofuran-5-carbonitrile CAS Name: 3-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-1-oxo-3H-isobenzofuran-5-carbonitrile IUPAC Name: 3-(5-fluoro-2,4-dioxopyrimidin-1-yl)-1-oxo-3H-2-benzofuran-5-carbonitrile Traditional Name: 3-(5-fluoro-2,4-diketo-pyrimidin-1-yl)-1-keto-phthalan-5-carbonitrile Formula: C13H6FN3O4 MolecularWeight: 287.202843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C#N)C(OC2=O)N3C=C(C(=O)NC3=O)F

Isomeric SMILES

C1=CC2=C(C=C1C#N)C(OC2=O)N3C=C(C(=O)NC3=O)F

InChI

InChI=1S/C13H6FN3O4/c14-9-5-17(13(20)16-10(9)18)11-8-3-6(4-15)1-2-7(8)12(19)21-11/h1-3,5,11H,(H,16,18,20)