3-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-3H-2-benzofuran-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-3H-2-benzofuran-1-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-3H-isobenzofuran-1-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-5,6-dimethoxy-phthalide Formula: C17H14O6 MolecularWeight: 314.28946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(OC2=O)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(OC2=O)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C17H14O6/c1-19-13-6-10-11(7-14(13)20-2)17(18)23-16(10)9-3-4-12-15(5-9)22-8-21-12/h3-7,16H,8H2,1-2H3