methyl (2S,3R)-2-(3,4-dimethoxyphenyl)-4-methanoyl-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxylate

Systemtic Name: methyl (2S,3R)-2-(3,4-dimethoxyphenyl)-4-methanoyl-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxylate Openeye Name: methyl (2S,3R)-2-(3,4-dimethoxyphenyl)-4-formyl-7-methoxy-2,3-dihydrobenzofuran-3-carboxylate CAS Name: (2S,3R)-2-(3,4-dimethoxyphenyl)-4-formyl-7-methoxy-2,3-dihydrobenzofuran-3-carboxylic acid methyl ester IUPAC Name: methyl (2S,3R)-2-(3,4-dimethoxyphenyl)-4-formyl-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxylate Traditional Name: (2S,3R)-2-(3,4-dimethoxyphenyl)-4-formyl-7-methoxy-coumaran-3-carboxylic acid methyl ester Formula: C20H20O7 MolecularWeight: 372.3686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C3=C(C=CC(=C3O2)OC)C=O)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2[C@@H](C3=C(C=CC(=C3O2)OC)C=O)C(=O)OC)OC

InChI

InChI=1S/C20H20O7/c1-23-13-7-5-11(9-15(13)25-3)18-17(20(22)26-4)16-12(10-21)6-8-14(24-2)19(16)27-18/h5-10,17-18H,1-4H3/t17-,18-/m1/s1