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

Systemtic Name: methyl 1-[5-fluoranyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanylidene-1H-2-benzofuran-4-carboxylate Openeye Name: methyl 1-(5-fluoro-2,4-dioxo-pyrimidin-1-yl)-3-oxo-1H-isobenzofuran-4-carboxylate CAS Name: 1-(5-fluoro-2,4-dioxo-1-pyrimidinyl)-3-oxo-1H-isobenzofuran-4-carboxylic acid methyl ester IUPAC Name: methyl 1-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-oxo-1H-2-benzofuran-4-carboxylate Traditional Name: 1-(5-fluoro-2,4-diketo-pyrimidin-1-yl)-3-keto-phthalan-4-carboxylic acid methyl ester Formula: C14H9FN2O6 MolecularWeight: 320.229463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9FN2O6/c1-22-12(19)7-4-2-3-6-9(7)13(20)23-11(6)17-5-8(15)10(18)16-14(17)21/h2-5,11H,1H3,(H,16,18,21)