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SMILES: n1c(c(ccc1)C#C)Br Canonical SMILES: C#Cc1cccnc1Br InChI: InChI=1S/C7H4BrN/c1-2-6-4-3-5-9-7(6)8/h1,3-5H InChIKey: HVRDZOHXNYKPRH-UHFFFAOYSA-N
CBID:813990 http://www.chembase.cn/molecule-813990.html