5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-1-(4-ethylphenyl)-6-oxidanyl-pyrimidine-2,4-dione

Systemtic Name: 5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-1-(4-ethylphenyl)-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-1-(4-ethylphenyl)-6-hydroxy-pyrimidine-2,4-dione CAS Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-1-(4-ethylphenyl)-6-hydroxypyrimidine-2,4-dione IUPAC Name: 5-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-1-(4-ethylphenyl)-6-hydroxypyrimidine-2,4-dione Traditional Name: 1-(4-ethylphenyl)-6-hydroxy-5-(3-keto-4,5-dimethoxy-phthalan-1-yl)pyrimidine-2,4-quinone Formula: C22H20N2O7 MolecularWeight: 424.4034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)O

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)O

InChI

InChI=1S/C22H20N2O7/c1-4-11-5-7-12(8-6-11)24-20(26)16(19(25)23-22(24)28)17-13-9-10-14(29-2)18(30-3)15(13)21(27)31-17/h5-10,17,26H,4H2,1-3H3,(H,23,25,28)