提示: 按住Ctrl键可以同时选择多个官能团
SMILES: c1(c2c(oc1)ccc(c2)CC)CC(=O)O Canonical SMILES: CCc1ccc2c(c1)c(co2)CC(=O)O InChI: InChI=1S/C12H12O3/c1-2-8-3-4-11-10(5-8)9(7-15-11)6-12(13)14/h3-5,7H,2,6H2,1H3,(H,13,14) InChIKey: XIELPSZKUUDDMN-UHFFFAOYSA-N
CBID:114778 http://www.chembase.cn/molecule-114778.html