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SMILES: N#Cc1ccc(Br)c(OC)c1 Canonical SMILES: COc1cc(C#N)ccc1Br InChI: InChI=1S/C8H6BrNO/c1-11-8-4-6(5-10)2-3-7(8)9/h2-4H,1H3 InChIKey: TWBFZKKJFREYES-UHFFFAOYSA-N
CBID:294460 http://www.chembase.cn/molecule-294460.html