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SMILES: Brc1c(cccc1)C(=O)CC#N Canonical SMILES: N#CCC(=O)c1ccccc1Br InChI: InChI=1S/C9H6BrNO/c10-8-4-2-1-3-7(8)9(12)5-6-11/h1-4H,5H2 InChIKey: KETIGQNBJUHYCA-UHFFFAOYSA-N
CBID:91354 http://www.chembase.cn/molecule-91354.html