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SMILES: c1(c2c(sc1)CN(C(=O)OC(C)(C)C)CC2)C(=O)O Canonical SMILES: O=C(N1CCc2c(C1)scc2C(=O)O)OC(C)(C)C InChI: InChI=1S/C13H17NO4S/c1-13(2,3)18-12(17)14-5-4-8-9(11(15)16)7-19-10(8)6-14/h7H,4-6H2,1-3H3,(H,15,16) InChIKey: IAGIOFJILQXGIA-UHFFFAOYSA-N
CBID:18889 http://www.chembase.cn/molecule-18889.html