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

Systemtic Name: methyl 4,6-bis(bromanyl)-2-methyl-5-(4-oxidanyl-3-propan-2-yl-phenoxy)-1-benzofuran-3-carboxylate Openeye Name: methyl 4,6-dibromo-5-(4-hydroxy-3-isopropyl-phenoxy)-2-methyl-benzofuran-3-carboxylate CAS Name: 4,6-dibromo-5-(4-hydroxy-3-propan-2-ylphenoxy)-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 4,6-dibromo-5-(4-hydroxy-3-propan-2-ylphenoxy)-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 4,6-dibromo-5-(4-hydroxy-3-isopropyl-phenoxy)-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C20H18Br2O5 MolecularWeight: 498.16192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18Br2O5/c1-9(2)12-7-11(5-6-14(12)23)27-19-13(21)8-15-17(18(19)22)16(10(3)26-15)20(24)25-4/h5-9,23H,1-4H3