ethyl 3-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]oxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]oxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]oxymethyl]coumarilic acid ethyl ester Formula: C22H20O7 MolecularWeight: 396.39

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C=CC3=CC(=C(C=C3)O)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)/C=C/C3=CC(=C(C=C3)O)OC

InChI

InChI=1S/C22H20O7/c1-3-27-22(25)21-16(15-6-4-5-7-18(15)29-21)13-28-20(24)11-9-14-8-10-17(23)19(12-14)26-2/h4-12,23H,3,13H2,1-2H3/b11-9+