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SMILES: n1(c(cc(c1C)Br)C#N)C Canonical SMILES: N#Cc1cc(c(n1C)C)Br InChI: InChI=1S/C7H7BrN2/c1-5-7(8)3-6(4-9)10(5)2/h3H,1-2H3 InChIKey: ALJTYVWCWBUADZ-UHFFFAOYSA-N
CBID:309921 http://www.chembase.cn/molecule-309921.html