ethyl 4-bromanyl-2-methanoyl-7-methyl-5-(3,4,5-trimethoxyphenyl)carbonyloxy-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 4-bromanyl-2-methanoyl-7-methyl-5-(3,4,5-trimethoxyphenyl)carbonyloxy-1-benzofuran-3-carboxylate Openeye Name: ethyl 4-bromo-2-formyl-7-methyl-5-(3,4,5-trimethoxybenzoyl)oxy-benzofuran-3-carboxylate CAS Name: 4-bromo-2-formyl-7-methyl-5-[oxo-(3,4,5-trimethoxyphenyl)methoxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-2-formyl-7-methyl-5-(3,4,5-trimethoxybenzoyl)oxy-1-benzofuran-3-carboxylate Traditional Name: 4-bromo-2-formyl-7-methyl-5-(3,4,5-trimethoxybenzoyl)oxy-benzofuran-3-carboxylic acid ethyl ester Formula: C23H21BrO9 MolecularWeight: 521.31144

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C=C2C)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)Br)C=O

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C=C2C)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)Br)C=O

InChI

InChI=1S/C23H21BrO9/c1-6-31-23(27)17-16(10-25)32-20-11(2)7-13(19(24)18(17)20)33-22(26)12-8-14(28-3)21(30-5)15(9-12)29-4/h7-10H,6H2,1-5H3