(3S)-6,7-dimethoxy-3-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]-3H-2-benzofuran-1-one

Systemtic Name: (3S)-6,7-dimethoxy-3-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethyl]-3H-2-benzofuran-1-one Openeye Name: (3S)-6,7-dimethoxy-3-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-3H-isobenzofuran-1-one CAS Name: (3S)-6,7-dimethoxy-3-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-3H-isobenzofuran-1-one IUPAC Name: (3S)-6,7-dimethoxy-3-[2-oxo-2-(3,4,5-trimethoxyphenyl)ethyl]-3H-2-benzofuran-1-one Traditional Name: (3S)-3-[2-keto-2-(3,4,5-trimethoxyphenyl)ethyl]-6,7-dimethoxy-phthalide Formula: C21H22O8 MolecularWeight: 402.39458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)CC(=O)C3=CC(=C(C(=C3)OC)OC)OC)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)[C@@H](OC2=O)CC(=O)C3=CC(=C(C(=C3)OC)OC)OC)OC

InChI

InChI=1S/C21H22O8/c1-24-14-7-6-12-15(29-21(23)18(12)20(14)28-5)10-13(22)11-8-16(25-2)19(27-4)17(9-11)26-3/h6-9,15H,10H2,1-5H3/t15-/m0/s1