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SMILES: OC(=O)c1c(cc(nc1)Br)OC Canonical SMILES: COc1cc(Br)ncc1C(=O)O InChI: InChI=1S/C7H6BrNO3/c1-12-5-2-6(8)9-3-4(5)7(10)11/h2-3H,1H3,(H,10,11) InChIKey: ZBVNYZOZHADYHH-UHFFFAOYSA-N
CBID:815089 http://www.chembase.cn/molecule-815089.html