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SMILES: B1(OC(C(O1)(C)C)(C)C)c1ccnc(c1C#N)Cl Canonical SMILES: N#Cc1c(ccnc1Cl)B1OC(C(O1)(C)C)(C)C InChI: InChI=1S/C12H14BClN2O2/c1-11(2)12(3,4)18-13(17-11)9-5-6-16-10(14)8(9)7-15/h5-6H,1-4H3 InChIKey: YYPZHORJYDCOSQ-UHFFFAOYSA-N
CBID:143056 http://www.chembase.cn/molecule-143056.html