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SMILES: c1(cnc(c(c1)N)C(=O)OC)Br Canonical SMILES: COC(=O)c1ncc(cc1N)Br InChI: InChI=1S/C7H7BrN2O2/c1-12-7(11)6-5(9)2-4(8)3-10-6/h2-3H,9H2,1H3 InChIKey: DWRSWUPHDNTLKJ-UHFFFAOYSA-N
CBID:54448 http://www.chembase.cn/molecule-54448.html