methyl 6-bromanyl-2-methyl-5-(2-oxidanylidene-2-phenylmethoxy-ethoxy)-1-benzofuran-3-carboxylate

Systemtic Name: methyl 6-bromanyl-2-methyl-5-(2-oxidanylidene-2-phenylmethoxy-ethoxy)-1-benzofuran-3-carboxylate Openeye Name: methyl 5-(2-benzyloxy-2-oxo-ethoxy)-6-bromo-2-methyl-benzofuran-3-carboxylate CAS Name: 6-bromo-2-methyl-5-(2-oxo-2-phenylmethoxyethoxy)-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 6-bromo-2-methyl-5-(2-oxo-2-phenylmethoxyethoxy)-1-benzofuran-3-carboxylate Traditional Name: 5-(2-benzoxy-2-keto-ethoxy)-6-bromo-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C20H17BrO6 MolecularWeight: 433.24938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2O1)Br)OCC(=O)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2O1)Br)OCC(=O)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C20H17BrO6/c1-12-19(20(23)24-2)14-8-17(15(21)9-16(14)27-12)25-11-18(22)26-10-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3