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SMILES: [nH]1nc(cc1C(=O)OC)CC Canonical SMILES: COC(=O)c1[nH]nc(c1)CC InChI: InChI=1S/C7H10N2O2/c1-3-5-4-6(9-8-5)7(10)11-2/h4H,3H2,1-2H3,(H,8,9) InChIKey: BNHJTPCDNQDUPI-UHFFFAOYSA-N
CBID:67521 http://www.chembase.cn/molecule-67521.html