3-[3-methanoyl-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-1-benzofuran-5-yl]propanoic acid

Systemtic Name: 3-[3-methanoyl-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-1-benzofuran-5-yl]propanoic acid Openeye Name: 3-[3-formyl-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-benzofuran-5-yl]propanoic acid CAS Name: 3-[3-formyl-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-benzofuranyl]propanoic acid IUPAC Name: 3-[3-formyl-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-1-benzofuran-5-yl]propanoic acid Traditional Name: 3-[3-formyl-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-benzofuran-5-yl]propionic acid Formula: C20H18O7 MolecularWeight: 370.35272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18O7/c1-25-16-9-12(4-5-15(16)22)19-14(10-21)13-7-11(3-6-18(23)24)8-17(26-2)20(13)27-19/h4-5,7-10,22H,3,6H2,1-2H3,(H,23,24)