methyl 2-[3,4-bis(oxidanyl)phenyl]-7-methoxy-5-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-benzofuran-3-carboxylate

Systemtic Name: methyl 2-[3,4-bis(oxidanyl)phenyl]-7-methoxy-5-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-1-benzofuran-3-carboxylate Openeye Name: methyl 2-(3,4-dihydroxyphenyl)-7-methoxy-5-[(E)-3-methoxy-3-oxo-prop-1-enyl]benzofuran-3-carboxylate CAS Name: 2-(3,4-dihydroxyphenyl)-7-methoxy-5-[(E)-3-methoxy-3-oxoprop-1-enyl]-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-(3,4-dihydroxyphenyl)-7-methoxy-5-[(E)-3-methoxy-3-oxoprop-1-enyl]-1-benzofuran-3-carboxylate Traditional Name: 2-(3,4-dihydroxyphenyl)-5-[(E)-3-keto-3-methoxy-prop-1-enyl]-7-methoxy-benzofuran-3-carboxylic acid methyl ester Formula: C21H18O8 MolecularWeight: 398.36282

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)C=CC(=O)OC)C(=C(O2)C3=CC(=C(C=C3)O)O)C(=O)OC

Isomeric SMILES

COC1=C2C(=CC(=C1)/C=C/C(=O)OC)C(=C(O2)C3=CC(=C(C=C3)O)O)C(=O)OC

InChI

InChI=1S/C21H18O8/c1-26-16-9-11(4-7-17(24)27-2)8-13-18(21(25)28-3)19(29-20(13)16)12-5-6-14(22)15(23)10-12/h4-10,22-23H,1-3H3/b7-4+