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SMILES: n12nc(cc1CNCCC2)CO Canonical SMILES: OCc1nn2c(c1)CNCCC2 InChI: InChI=1S/C8H13N3O/c12-6-7-4-8-5-9-2-1-3-11(8)10-7/h4,9,12H,1-3,5-6H2 InChIKey: OMXZUACVERIOMC-UHFFFAOYSA-N
CBID:51042 http://www.chembase.cn/molecule-51042.html