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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)C(OC2=O)N3C=C(C(=O)NC3=O)F)C#N

Isomeric SMILES

C1=CC(=C2C(=C1)C(OC2=O)N3C=C(C(=O)NC3=O)F)C#N

InChI

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