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SMILES: c1(nc(cc(n1)Cl)O)N.O Canonical SMILES: Oc1cc(Cl)nc(n1)N.O InChI: InChI=1S/C4H4ClN3O.H2O/c5-2-1-3(9)8-4(6)7-2;/h1H,(H3,6,7,8,9);1H2 InChIKey: KBQIJULVUFJCMD-UHFFFAOYSA-N
CBID:67954 http://www.chembase.cn/molecule-67954.html