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SMILES: O=C(c1cc(c(cc1)C#N)CBr)OC Canonical SMILES: COC(=O)c1ccc(c(c1)CBr)C#N InChI: InChI=1S/C10H8BrNO2/c1-14-10(13)7-2-3-8(6-12)9(4-7)5-11/h2-4H,5H2,1H3 InChIKey: YFQVXOFHILWYNN-UHFFFAOYSA-N
CBID:83794 http://www.chembase.cn/molecule-83794.html