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SMILES: N#Cc1c[nH]ccc1=O Canonical SMILES: O=c1cc[nH]cc1C#N InChI: InChI=1S/C6H4N2O/c7-3-5-4-8-2-1-6(5)9/h1-2,4H,(H,8,9) InChIKey: ZSGWFOMHWZIAEW-UHFFFAOYSA-N
CBID:288628 http://www.chembase.cn/molecule-288628.html