methyl 3-[3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-1-benzofuran-5-yl]propanoate

Systemtic Name: methyl 3-[3-(hydroxymethyl)-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-1-benzofuran-5-yl]propanoate Openeye Name: methyl 3-[2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-7-methoxy-benzofuran-5-yl]propanoate CAS Name: 3-[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-5-benzofuranyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-1-benzofuran-5-yl]propanoate Traditional Name: 3-[2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-3-methylol-benzofuran-5-yl]propionic acid methyl ester Formula: C21H22O7 MolecularWeight: 386.39518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=C(C3=CC(=CC(=C3O2)OC)CCC(=O)OC)CO)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2=C(C3=CC(=CC(=C3O2)OC)CCC(=O)OC)CO)O

InChI

InChI=1S/C21H22O7/c1-25-17-10-13(5-6-16(17)23)20-15(11-22)14-8-12(4-7-19(24)27-3)9-18(26-2)21(14)28-20/h5-6,8-10,22-23H,4,7,11H2,1-3H3