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SMILES: n1c(cnc(c1)C)C=O Canonical SMILES: Cc1cnc(cn1)C=O InChI: InChI=1S/C6H6N2O/c1-5-2-8-6(4-9)3-7-5/h2-4H,1H3 InChIKey: JUPFEWGPEBACJP-UHFFFAOYSA-N
CBID:88156 http://www.chembase.cn/molecule-88156.html