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SMILES: c1(c(cc(c(c1)C)S(=O)(=O)O)OC)N Canonical SMILES: COc1cc(c(cc1N)C)S(=O)(=O)O InChI: InChI=1S/C8H11NO4S/c1-5-3-6(9)7(13-2)4-8(5)14(10,11)12/h3-4H,9H2,1-2H3,(H,10,11,12) InChIKey: JBAVAJIXZVRJHT-UHFFFAOYSA-N
CBID:160104 http://www.chembase.cn/molecule-160104.html