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SMILES: Nc1nc(C=O)ccc1 Canonical SMILES: O=Cc1cccc(n1)N InChI: InChI=1S/C6H6N2O/c7-6-3-1-2-5(4-9)8-6/h1-4H,(H2,7,8) InChIKey: PXYOOBSFOBZSBX-UHFFFAOYSA-N
CBID:288612 http://www.chembase.cn/molecule-288612.html