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SMILES: n1cnc(c(c1O)CC)O Canonical SMILES: CCc1c(O)ncnc1O InChI: InChI=1S/C6H8N2O2/c1-2-4-5(9)7-3-8-6(4)10/h3H,2H2,1H3,(H2,7,8,9,10) InChIKey: PYZFNSYJSDPLHL-UHFFFAOYSA-N
CBID:80152 http://www.chembase.cn/molecule-80152.html