提示: 按住Ctrl键可以同时选择多个官能团
SMILES: c1(n[nH]c(c1)c1c(C#N)cccc1)C(=O)OC Canonical SMILES: COC(=O)c1n[nH]c(c1)c1ccccc1C#N InChI: InChI=1S/C12H9N3O2/c1-17-12(16)11-6-10(14-15-11)9-5-3-2-4-8(9)7-13/h2-6H,1H3,(H,14,15) InChIKey: KIHGIEBTMSZERX-UHFFFAOYSA-N
CBID:247218 http://www.chembase.cn/molecule-247218.html