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SMILES: Nc1oc(cn1)c1ccc(cc1)Br Canonical SMILES: Brc1ccc(cc1)c1cnc(o1)N InChI: InChI=1S/C9H7BrN2O/c10-7-3-1-6(2-4-7)8-5-12-9(11)13-8/h1-5H,(H2,11,12) InChIKey: IOHKMNVCWGUVBX-UHFFFAOYSA-N
CBID:806693 http://www.chembase.cn/molecule-806693.html