ethyl 6-bromanyl-5-(3,4-dimethoxyphenyl)carbonyloxy-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-5-(3,4-dimethoxyphenyl)carbonyloxy-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-(3,4-dimethoxybenzoyl)oxy-2-methyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-[(3,4-dimethoxyphenyl)-oxomethoxy]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-(3,4-dimethoxybenzoyl)oxy-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-methyl-5-veratroyloxy-benzofuran-3-carboxylic acid ethyl ester Formula: C21H19BrO7 MolecularWeight: 463.27536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C3=CC(=C(C=C3)OC)OC)Br)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C3=CC(=C(C=C3)OC)OC)Br)C

InChI

InChI=1S/C21H19BrO7/c1-5-27-21(24)19-11(2)28-16-10-14(22)17(9-13(16)19)29-20(23)12-6-7-15(25-3)18(8-12)26-4/h6-10H,5H2,1-4H3