2-methoxyethyl 6-bromanyl-2-methyl-5-phenacyloxy-1-benzofuran-3-carboxylate

Systemtic Name: 2-methoxyethyl 6-bromanyl-2-methyl-5-phenacyloxy-1-benzofuran-3-carboxylate Openeye Name: 2-methoxyethyl 6-bromo-2-methyl-5-phenacyloxy-benzofuran-3-carboxylate CAS Name: 6-bromo-2-methyl-5-phenacyloxy-3-benzofurancarboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 6-bromo-2-methyl-5-phenacyloxy-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-methyl-5-phenacyloxy-benzofuran-3-carboxylic acid 2-methoxyethyl ester Formula: C21H19BrO6 MolecularWeight: 447.27596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19BrO6/c1-13-20(21(24)26-9-8-25-2)15-10-19(16(22)11-18(15)28-13)27-12-17(23)14-6-4-3-5-7-14/h3-7,10-11H,8-9,12H2,1-2H3