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

Systemtic Name: 2-methoxyethyl 6-bromanyl-2-methyl-5-(2-oxidanylidene-2-phenylmethoxy-ethoxy)-1-benzofuran-3-carboxylate Openeye Name: 2-methoxyethyl 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 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 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 2-methoxyethyl ester Formula: C22H21BrO7 MolecularWeight: 477.30194

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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)OCCOC

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrO7/c1-14-21(22(25)27-9-8-26-2)16-10-19(17(23)11-18(16)30-14)28-13-20(24)29-12-15-6-4-3-5-7-15/h3-7,10-11H,8-9,12-13H2,1-2H3