提示: 按住Ctrl键可以同时选择多个官能团
SMILES: OC(=O)CN(CC(=O)O)c1c(C#N)c(CC(=O)O)c(s1)C(=O)O Canonical SMILES: N#Cc1c(sc(c1CC(=O)O)C(=O)O)N(CC(=O)O)CC(=O)O InChI: InChI=1S/C12H10N2O8S/c13-2-6-5(1-7(15)16)10(12(21)22)23-11(6)14(3-8(17)18)4-9(19)20/h1,3-4H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22) InChIKey: DJSXNILVACEBLP-UHFFFAOYSA-N
CBID:129235 http://www.chembase.cn/molecule-129235.html