propan-2-yl 6-bromanyl-2-methyl-5-(phenylcarbonyloxy)-1-benzofuran-3-carboxylate

Systemtic Name: propan-2-yl 6-bromanyl-2-methyl-5-(phenylcarbonyloxy)-1-benzofuran-3-carboxylate Openeye Name: isopropyl 5-benzoyloxy-6-bromo-2-methyl-benzofuran-3-carboxylate CAS Name: 5-benzoyloxy-6-bromo-2-methyl-3-benzofurancarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 5-benzoyloxy-6-bromo-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-benzoyloxy-6-bromo-2-methyl-benzofuran-3-carboxylic acid isopropyl ester Formula: C20H17BrO5 MolecularWeight: 417.24998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17BrO5/c1-11(2)24-20(23)18-12(3)25-16-10-15(21)17(9-14(16)18)26-19(22)13-7-5-4-6-8-13/h4-11H,1-3H3