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SMILES: [nH]1c(=O)cc(cc1)C#N Canonical SMILES: N#Cc1cc[nH]c(=O)c1 InChI: InChI=1S/C6H4N2O/c7-4-5-1-2-8-6(9)3-5/h1-3H,(H,8,9) InChIKey: QCOIIYBOBZFBJE-UHFFFAOYSA-N
CBID:796550 http://www.chembase.cn/molecule-796550.html