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SMILES: Br.c1(C(=O)OC)cc(c(cc1)CN)Cl Canonical SMILES: COC(=O)c1ccc(c(c1)Cl)CN.Br InChI: InChI=1S/C9H10ClNO2.BrH/c1-13-9(12)6-2-3-7(5-11)8(10)4-6;/h2-4H,5,11H2,1H3;1H InChIKey: CDBIKPPWAJQYFN-UHFFFAOYSA-N
CBID:814619 http://www.chembase.cn/molecule-814619.html