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SMILES: B1(c2cc(nc(c2)Cl)C)OC(C)(C)C(O1)(C)C Canonical SMILES: Cc1nc(Cl)cc(c1)B1OC(C(O1)(C)C)(C)C InChI: InChI=1S/C12H17BClNO2/c1-8-6-9(7-10(14)15-8)13-16-11(2,3)12(4,5)17-13/h6-7H,1-5H3 InChIKey: CDNAAWYZHQPEAX-UHFFFAOYSA-N
CBID:78059 http://www.chembase.cn/molecule-78059.html