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

Systemtic Name: 5-(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)-1-(4-iodophenyl)-6-oxidanyl-pyrimidine-2,4-dione Openeye Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-1-(4-iodophenyl)pyrimidine-2,4-dione CAS Name: 5-(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)-6-hydroxy-1-(4-iodophenyl)pyrimidine-2,4-dione IUPAC Name: 5-(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)-6-hydroxy-1-(4-iodophenyl)pyrimidine-2,4-dione Traditional Name: 6-hydroxy-1-(4-iodophenyl)-5-(3-keto-4,5-dimethoxy-phthalan-1-yl)pyrimidine-2,4-quinone Formula: C20H15IN2O7 MolecularWeight: 522.24677

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15IN2O7/c1-28-12-8-7-11-13(16(12)29-2)19(26)30-15(11)14-17(24)22-20(27)23(18(14)25)10-5-3-9(21)4-6-10/h3-8,15,25H,1-2H3,(H,22,24,27)