5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-1-[2-(4-fluorophenyl)ethyl]-6-oxidanyl-pyrimidine-2,4-dione

Systemtic Name: 5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-1-[2-(4-fluorophenyl)ethyl]-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-1-[2-(4-fluorophenyl)ethyl]-6-hydroxy-pyrimidine-2,4-dione CAS Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-1-[2-(4-fluorophenyl)ethyl]-6-hydroxypyrimidine-2,4-dione IUPAC Name: 5-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-1-[2-(4-fluorophenyl)ethyl]-6-hydroxypyrimidine-2,4-dione Traditional Name: 1-[2-(4-fluorophenyl)ethyl]-6-hydroxy-5-(3-keto-4,5-dimethoxy-phthalan-1-yl)pyrimidine-2,4-quinone Formula: C22H19FN2O7 MolecularWeight: 442.393863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(N(C(=O)NC3=O)CCC4=CC=C(C=C4)F)O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)C3=C(N(C(=O)NC3=O)CCC4=CC=C(C=C4)F)O)OC

InChI

InChI=1S/C22H19FN2O7/c1-30-14-8-7-13-15(18(14)31-2)21(28)32-17(13)16-19(26)24-22(29)25(20(16)27)10-9-11-3-5-12(23)6-4-11/h3-8,17,27H,9-10H2,1-2H3,(H,24,26,29)