methyl 4,6-bis(bromanyl)-5-(4-methoxy-3-propan-2-yl-phenoxy)-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: methyl 4,6-bis(bromanyl)-5-(4-methoxy-3-propan-2-yl-phenoxy)-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 4,6-dibromo-5-(3-isopropyl-4-methoxy-phenoxy)-2-methyl-benzofuran-3-carboxylate CAS Name: 4,6-dibromo-5-(4-methoxy-3-propan-2-ylphenoxy)-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 4,6-dibromo-5-(4-methoxy-3-propan-2-ylphenoxy)-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 4,6-dibromo-5-(3-isopropyl-4-methoxy-phenoxy)-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C21H20Br2O5 MolecularWeight: 512.1885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C(C=C2O1)Br)OC3=CC(=C(C=C3)OC)C(C)C)Br)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(C(=C(C=C2O1)Br)OC3=CC(=C(C=C3)OC)C(C)C)Br)C(=O)OC

InChI

InChI=1S/C21H20Br2O5/c1-10(2)13-8-12(6-7-15(13)25-4)28-20-14(22)9-16-18(19(20)23)17(11(3)27-16)21(24)26-5/h6-10H,1-5H3