4,5-bis(chloranyl)-3-(4,6-dimethoxypyrimidin-2-yl)-3-oxidanyl-2-benzofuran-1-one

Systemtic Name: 4,5-bis(chloranyl)-3-(4,6-dimethoxypyrimidin-2-yl)-3-oxidanyl-2-benzofuran-1-one Openeye Name: 4,5-dichloro-3-(4,6-dimethoxypyrimidin-2-yl)-3-hydroxy-isobenzofuran-1-one CAS Name: 4,5-dichloro-3-(4,6-dimethoxy-2-pyrimidinyl)-3-hydroxy-1-isobenzofuranone IUPAC Name: 4,5-dichloro-3-(4,6-dimethoxypyrimidin-2-yl)-3-hydroxy-2-benzofuran-1-one Traditional Name: 4,5-dichloro-3-(4,6-dimethoxypyrimidin-2-yl)-3-hydroxy-phthalide Formula: C14H10Cl2N2O5 MolecularWeight: 357.1456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C2(C3=C(C=CC(=C3Cl)Cl)C(=O)O2)O)OC

Isomeric SMILES

COC1=CC(=NC(=N1)C2(C3=C(C=CC(=C3Cl)Cl)C(=O)O2)O)OC

InChI

InChI=1S/C14H10Cl2N2O5/c1-21-8-5-9(22-2)18-13(17-8)14(20)10-6(12(19)23-14)3-4-7(15)11(10)16/h3-5,20H,1-2H3