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SMILES: n1(c2c(c(c1)CO)cccn2)C(=O)OC(C)(C)C Canonical SMILES: OCc1cn(c2c1cccn2)C(=O)OC(C)(C)C InChI: InChI=1S/C13H16N2O3/c1-13(2,3)18-12(17)15-7-9(8-16)10-5-4-6-14-11(10)15/h4-7,16H,8H2,1-3H3 InChIKey: XPXXDPUPBVIHGK-UHFFFAOYSA-N
CBID:51867 http://www.chembase.cn/molecule-51867.html