ethyl 6-bromanyl-2-methyl-5-(2-methylphenyl)carbonyloxy-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-methyl-5-(2-methylphenyl)carbonyloxy-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-2-methyl-5-(2-methylbenzoyl)oxy-benzofuran-3-carboxylate CAS Name: 6-bromo-2-methyl-5-[(2-methylphenyl)-oxomethoxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-methyl-5-(2-methylbenzoyl)oxy-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-methyl-5-o-toluoyloxy-benzofuran-3-carboxylic acid ethyl ester Formula: C20H17BrO5 MolecularWeight: 417.24998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C3=CC=CC=C3C)Br)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(=O)C3=CC=CC=C3C)Br)C

InChI

InChI=1S/C20H17BrO5/c1-4-24-20(23)18-12(3)25-16-10-15(21)17(9-14(16)18)26-19(22)13-8-6-5-7-11(13)2/h5-10H,4H2,1-3H3