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SMILES: O=C(O)c1cnc(O)cc1Br Canonical SMILES: Oc1ncc(c(c1)Br)C(=O)O InChI: InChI=1S/C6H4BrNO3/c7-4-1-5(9)8-2-3(4)6(10)11/h1-2H,(H,8,9)(H,10,11) InChIKey: LOXKNBSOLALQFL-UHFFFAOYSA-N
CBID:289126 http://www.chembase.cn/molecule-289126.html