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SMILES: n12c(ncc2)[nH]ccc1=O Canonical SMILES: O=c1cc[nH]c2n1ccn2 InChI: InChI=1S/C6H5N3O/c10-5-1-2-7-6-8-3-4-9(5)6/h1-4H,(H,7,8) InChIKey: UUHMFGQYTIQQIS-UHFFFAOYSA-N
CBID:61902 http://www.chembase.cn/molecule-61902.html