ethyl 4-bromanyl-2-methanoyl-7-methyl-5-(2-methylpropanoyloxy)-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 4-bromanyl-2-methanoyl-7-methyl-5-(2-methylpropanoyloxy)-1-benzofuran-3-carboxylate Openeye Name: ethyl 4-bromo-2-formyl-7-methyl-5-(2-methylpropanoyloxy)benzofuran-3-carboxylate CAS Name: 4-bromo-2-formyl-7-methyl-5-(2-methyl-1-oxopropoxy)-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-bromo-2-formyl-7-methyl-5-(2-methylpropanoyloxy)-1-benzofuran-3-carboxylate Traditional Name: 4-bromo-2-formyl-5-isobutyryloxy-7-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C17H17BrO6 MolecularWeight: 397.21728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=C(C=C2C)OC(=O)C(C)C)Br)C=O

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=C(C=C2C)OC(=O)C(C)C)Br)C=O

InChI

InChI=1S/C17H17BrO6/c1-5-22-17(21)12-11(7-19)23-15-9(4)6-10(14(18)13(12)15)24-16(20)8(2)3/h6-8H,5H2,1-4H3