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SMILES: C(=O)c1c(cc(cc1)OC)OCC1CC1 Canonical SMILES: COc1ccc(c(c1)OCC1CC1)C=O InChI: InChI=1S/C12H14O3/c1-14-11-5-4-10(7-13)12(6-11)15-8-9-2-3-9/h4-7,9H,2-3,8H2,1H3 InChIKey: LLCHCHOIQQREPI-UHFFFAOYSA-N
CBID:180306 http://www.chembase.cn/molecule-180306.html