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SMILES: c1(cnc(c(c1)B1OC(C(O1)(C)C)(C)C)OC)Cl Canonical SMILES: COc1ncc(cc1B1OC(C(O1)(C)C)(C)C)Cl InChI: InChI=1S/C12H17BClNO3/c1-11(2)12(3,4)18-13(17-11)9-6-8(14)7-15-10(9)16-5/h6-7H,1-5H3 InChIKey: XEOYFUBNOQGVKM-UHFFFAOYSA-N
CBID:54524 http://www.chembase.cn/molecule-54524.html