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SMILES: c1(cnc(cc1)Br)O Canonical SMILES: Brc1ccc(cn1)O InChI: InChI=1S/C5H4BrNO/c6-5-2-1-4(8)3-7-5/h1-3,8H InChIKey: PTEFNEALEPSHLC-UHFFFAOYSA-N
CBID:16355 http://www.chembase.cn/molecule-16355.html