3,7-bis(chloranyl)-3-(4,6-dimethoxypyrimidin-2-yl)-2-benzofuran-1-one

Systemtic Name: 3,7-bis(chloranyl)-3-(4,6-dimethoxypyrimidin-2-yl)-2-benzofuran-1-one Openeye Name: 3,7-dichloro-3-(4,6-dimethoxypyrimidin-2-yl)isobenzofuran-1-one CAS Name: 3,7-dichloro-3-(4,6-dimethoxy-2-pyrimidinyl)-1-isobenzofuranone IUPAC Name: 3,7-dichloro-3-(4,6-dimethoxypyrimidin-2-yl)-2-benzofuran-1-one Traditional Name: 3,7-dichloro-3-(4,6-dimethoxypyrimidin-2-yl)phthalide Formula: C14H10Cl2N2O4 MolecularWeight: 341.1462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10Cl2N2O4/c1-20-9-6-10(21-2)18-13(17-9)14(16)7-4-3-5-8(15)11(7)12(19)22-14/h3-6H,1-2H3