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SMILES: B1(OC(C(O1)(C)C)(C)C)c1c(C#N)cncc1 Canonical SMILES: N#Cc1cnccc1B1OC(C(O1)(C)C)(C)C InChI: InChI=1S/C12H15BN2O2/c1-11(2)12(3,4)17-13(16-11)10-5-6-15-8-9(10)7-14/h5-6,8H,1-4H3 InChIKey: LUDBQHAQFBWGNI-UHFFFAOYSA-N
CBID:71301 http://www.chembase.cn/molecule-71301.html