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SMILES: c12c(c(c(c(=O)o1)CC)C)cc1c(c2C)occ1c1ccc(cc1)Br Canonical SMILES: CCc1c(=O)oc2c(c1C)cc1c(c2C)occ1c1ccc(cc1)Br InChI: InChI=1S/C21H17BrO3/c1-4-15-11(2)16-9-17-18(13-5-7-14(22)8-6-13)10-24-19(17)12(3)20(16)25-21(15)23/h5-10H,4H2,1-3H3 InChIKey: ZUZDCEPGWIVAOE-UHFFFAOYSA-N
CBID:194021 http://www.chembase.cn/molecule-194021.html