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

Systemtic Name: (3S)-3-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one Openeye Name: (3S)-3-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: (3S)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-6,7-dimethoxy-3H-isobenzofuran-1-one IUPAC Name: (3S)-3-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: (3S)-3-[2-(3,4-dimethoxyphenyl)-2-keto-ethyl]-6,7-dimethoxy-phthalide Formula: C20H20O7 MolecularWeight: 372.3686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CC2C3=C(C(=C(C=C3)OC)OC)C(=O)O2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C[C@H]2C3=C(C(=C(C=C3)OC)OC)C(=O)O2)OC

InChI

InChI=1S/C20H20O7/c1-23-14-7-5-11(9-17(14)25-3)13(21)10-16-12-6-8-15(24-2)19(26-4)18(12)20(22)27-16/h5-9,16H,10H2,1-4H3/t16-/m0/s1