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SMILES: c12n(nc(c1Br)C(=O)O)c(cc(n2)C)C Canonical SMILES: Cc1cc(C)n2c(n1)c(Br)c(n2)C(=O)O InChI: InChI=1S/C9H8BrN3O2/c1-4-3-5(2)13-8(11-4)6(10)7(12-13)9(14)15/h3H,1-2H3,(H,14,15) InChIKey: HIELEKYFBAMFQZ-UHFFFAOYSA-N
CBID:37999 http://www.chembase.cn/molecule-37999.html