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SMILES: c12c(c(ccc2CCCC1=O)OC)Br Canonical SMILES: COc1ccc2c(c1Br)C(=O)CCC2 InChI: InChI=1S/C11H11BrO2/c1-14-9-6-5-7-3-2-4-8(13)10(7)11(9)12/h5-6H,2-4H2,1H3 InChIKey: LKQNUNKQQFTEDQ-UHFFFAOYSA-N
CBID:71037 http://www.chembase.cn/molecule-71037.html