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SMILES: c1(C(=O)CBr)cc(ccc1)C#N Canonical SMILES: BrCC(=O)c1cccc(c1)C#N InChI: InChI=1S/C9H6BrNO/c10-5-9(12)8-3-1-2-7(4-8)6-11/h1-4H,5H2 InChIKey: XWCGNFLHRINYCE-UHFFFAOYSA-N
CBID:40360 http://www.chembase.cn/molecule-40360.html