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SMILES: c12c(c(cc(c2)Cl)Br)OCCC1=O Canonical SMILES: Clc1cc(Br)c2c(c1)C(=O)CCO2 InChI: InChI=1S/C9H6BrClO2/c10-7-4-5(11)3-6-8(12)1-2-13-9(6)7/h3-4H,1-2H2 InChIKey: YSDPWUIFEAAHIG-UHFFFAOYSA-N
CBID:50804 http://www.chembase.cn/molecule-50804.html