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SMILES: n1cc(ccc1I)C#N Canonical SMILES: N#Cc1ccc(nc1)I InChI: InChI=1S/C6H3IN2/c7-6-2-1-5(3-8)4-9-6/h1-2,4H InChIKey: OSZBCDXCSFPFSX-UHFFFAOYSA-N
CBID:87813 http://www.chembase.cn/molecule-87813.html