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SMILES: Oc1ccc(Br)nc1C Canonical SMILES: Brc1ccc(c(n1)C)O InChI: InChI=1S/C6H6BrNO/c1-4-5(9)2-3-6(7)8-4/h2-3,9H,1H3 InChIKey: NZEZVKXETZALTH-UHFFFAOYSA-N
CBID:289248 http://www.chembase.cn/molecule-289248.html