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SMILES: c1(ccnc(c1)C=O)N Canonical SMILES: Nc1cc(C=O)ncc1 InChI: InChI=1S/C6H6N2O/c7-5-1-2-8-6(3-5)4-9/h1-4H,(H2,7,8) InChIKey: ZYUBKKLABNQIDE-UHFFFAOYSA-N
CBID:815176 http://www.chembase.cn/molecule-815176.html