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

Systemtic Name: (E)-3-[3-methanoyl-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-1-benzofuran-5-yl]prop-2-enoic acid Openeye Name: (E)-3-[3-formyl-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-benzofuran-5-yl]prop-2-enoic acid CAS Name: (E)-3-[3-formyl-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-benzofuranyl]-2-propenoic acid IUPAC Name: (E)-3-[3-formyl-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-1-benzofuran-5-yl]prop-2-enoic acid Traditional Name: (E)-3-[3-formyl-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-benzofuran-5-yl]acrylic acid Formula: C20H16O7 MolecularWeight: 368.33684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16O7/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/h3-10,22H,1-2H3,(H,23,24)/b6-3+