提示: 按住Ctrl键可以同时选择多个官能团
SMILES: [nH]1c(c(c(c1C#C)C)C)C=O Canonical SMILES: O=Cc1[nH]c(c(c1C)C)C#C InChI: InChI=1S/C9H9NO/c1-4-8-6(2)7(3)9(5-11)10-8/h1,5,10H,2-3H3 InChIKey: NXHUAPUCITTYBZ-UHFFFAOYSA-N
CBID:799196 http://www.chembase.cn/molecule-799196.html