ethyl 5-bromanyl-3-[(3,4-dimethoxyphenyl)carbonyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-[(3,4-dimethoxyphenyl)carbonyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-[(3,4-dimethoxybenzoyl)oxymethyl]benzofuran-2-carboxylate CAS Name: 5-bromo-3-[[(3,4-dimethoxyphenyl)-oxomethoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[(3,4-dimethoxybenzoyl)oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-(veratroyloxymethyl)coumarilic acid ethyl ester Formula: C21H19BrO7 MolecularWeight: 463.27536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H19BrO7/c1-4-27-21(24)19-15(14-10-13(22)6-8-16(14)29-19)11-28-20(23)12-5-7-17(25-2)18(9-12)26-3/h5-10H,4,11H2,1-3H3