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SMILES: S(=O)(=O)(N1C(C(=O)OC)CC(C1)O)c1ccc(cc1)C Canonical SMILES: COC(=O)C1CC(CN1S(=O)(=O)c1ccc(cc1)C)O InChI: InChI=1S/C13H17NO5S/c1-9-3-5-11(6-4-9)20(17,18)14-8-10(15)7-12(14)13(16)19-2/h3-6,10,12,15H,7-8H2,1-2H3 InChIKey: XUMMBVXGIOJOPC-UHFFFAOYSA-N
CBID:42564 http://www.chembase.cn/molecule-42564.html