ethyl 5-bromanyl-3-methyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-methyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-methyl-4-oxo-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: 5-bromo-3-methyl-4-oxo-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-methyl-4-oxo-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-4-keto-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid ethyl ester Formula: C12H13BrO4 MolecularWeight: 301.13322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)CCC(C2=O)Br)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)CCC(C2=O)Br)C

InChI

InChI=1S/C12H13BrO4/c1-3-16-12(15)11-6(2)9-8(17-11)5-4-7(13)10(9)14/h7H,3-5H2,1-2H3