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SMILES: n1nc(ccc1C)C=O Canonical SMILES: Cc1ccc(nn1)C=O InChI: InChI=1S/C6H6N2O/c1-5-2-3-6(4-9)8-7-5/h2-4H,1H3 InChIKey: OPKGSXZJDAALJL-UHFFFAOYSA-N
CBID:806459 http://www.chembase.cn/molecule-806459.html