methyl (2R,3R)-7-methoxy-5-(3-methoxy-3-oxidanylidene-propyl)-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1-benzofuran-3-carboxylate

Systemtic Name: methyl (2R,3R)-7-methoxy-5-(3-methoxy-3-oxidanylidene-propyl)-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1-benzofuran-3-carboxylate Openeye Name: methyl (2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-5-(3-methoxy-3-oxo-propyl)-2,3-dihydrobenzofuran-3-carboxylate CAS Name: (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxopropyl)-2,3-dihydrobenzofuran-3-carboxylic acid methyl ester IUPAC Name: methyl (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxopropyl)-2,3-dihydro-1-benzofuran-3-carboxylate Traditional Name: (2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-5-(3-keto-3-methoxy-propyl)-7-methoxy-coumaran-3-carboxylic acid methyl ester Formula: C22H24O8 MolecularWeight: 416.42116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24O8/c1-26-16-11-13(6-7-15(16)23)20-19(22(25)29-4)14-9-12(5-8-18(24)28-3)10-17(27-2)21(14)30-20/h6-7,9-11,19-20,23H,5,8H2,1-4H3/t19-,20+/m1/s1