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SMILES: c1(c2c(nc(c1)C)ccc(c2)Br)C(=O)OCC Canonical SMILES: Cc1cc(C(=O)OCC)c2c(n1)ccc(c2)Br InChI: InChI=1S/C13H12BrNO2/c1-3-17-13(16)11-6-8(2)15-12-5-4-9(14)7-10(11)12/h4-7H,3H2,1-2H3 InChIKey: KOVIYCANWGLBHA-UHFFFAOYSA-N
CBID:100999 http://www.chembase.cn/molecule-100999.html