5-(4-ethyl-5-oxidanyl-3-oxidanylidene-1H-2-benzofuran-1-yl)-6-methoxy-1-(4-methoxyphenyl)pyrimidine-2,4-dione

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC2=C1C(=O)OC2C3=C(N(C(=O)NC3=O)C4=CC=C(C=C4)OC)OC)O

Isomeric SMILES

CCC1=C(C=CC2=C1C(=O)OC2C3=C(N(C(=O)NC3=O)C4=CC=C(C=C4)OC)OC)O

InChI

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