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SMILES: Cc1nn(C(=O)OC(C)(C)C)c2ncc(Br)cc12 Canonical SMILES: Brc1cnc2c(c1)c(C)nn2C(=O)OC(C)(C)C InChI: InChI=1S/C12H14BrN3O2/c1-7-9-5-8(13)6-14-10(9)16(15-7)11(17)18-12(2,3)4/h5-6H,1-4H3 InChIKey: ZVHYMSMKXHSFLB-UHFFFAOYSA-N
CBID:291858 http://www.chembase.cn/molecule-291858.html