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SMILES: C(O)c1cc(c2nc(ccc2)Br)cnc1 Canonical SMILES: OCc1cncc(c1)c1cccc(n1)Br InChI: InChI=1S/C11H9BrN2O/c12-11-3-1-2-10(14-11)9-4-8(7-15)5-13-6-9/h1-6,15H,7H2 InChIKey: NGSHSZHSVHLWPQ-UHFFFAOYSA-N
CBID:795698 http://www.chembase.cn/molecule-795698.html