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

Systemtic Name: ethyl 6-bromanyl-5-(3,4-dimethoxyphenyl)carbonyloxy-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-5-(3,4-dimethoxybenzoyl)oxy-2-phenyl-benzofuran-3-carboxylate CAS Name: 6-bromo-5-[(3,4-dimethoxyphenyl)-oxomethoxy]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-5-(3,4-dimethoxybenzoyl)oxy-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-phenyl-5-veratroyloxy-benzofuran-3-carboxylic acid ethyl ester Formula: C26H21BrO7 MolecularWeight: 525.34474

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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)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C3=CC(=C(C=C3)OC)OC)Br)C4=CC=CC=C4

InChI

InChI=1S/C26H21BrO7/c1-4-32-26(29)23-17-13-21(34-25(28)16-10-11-19(30-2)22(12-16)31-3)18(27)14-20(17)33-24(23)15-8-6-5-7-9-15/h5-14H,4H2,1-3H3