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

Systemtic Name: 4,6-bis(bromanyl)-5-(4-oxidanyl-3-propan-2-yl-phenoxy)-1-benzofuran-2-carboxylic acid Openeye Name: 4,6-dibromo-5-(4-hydroxy-3-isopropyl-phenoxy)benzofuran-2-carboxylic acid CAS Name: 4,6-dibromo-5-(4-hydroxy-3-propan-2-ylphenoxy)-2-benzofurancarboxylic acid IUPAC Name: 4,6-dibromo-5-(4-hydroxy-3-propan-2-ylphenoxy)-1-benzofuran-2-carboxylic acid Traditional Name: 4,6-dibromo-5-(4-hydroxy-3-isopropyl-phenoxy)coumarilic acid Formula: C18H14Br2O5 MolecularWeight: 470.10876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=C(C=C3C(=C2Br)C=C(O3)C(=O)O)Br)O

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=C(C=C3C(=C2Br)C=C(O3)C(=O)O)Br)O

InChI

InChI=1S/C18H14Br2O5/c1-8(2)10-5-9(3-4-13(10)21)24-17-12(19)7-14-11(16(17)20)6-15(25-14)18(22)23/h3-8,21H,1-2H3,(H,22,23)