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SMILES: c1(c(ccc(c1)CCC)OCCC)C=O Canonical SMILES: CCCOc1ccc(cc1C=O)CCC InChI: InChI=1S/C13H18O2/c1-3-5-11-6-7-13(15-8-4-2)12(9-11)10-14/h6-7,9-10H,3-5,8H2,1-2H3 InChIKey: FBLNIMHMDDWYAM-UHFFFAOYSA-N
CBID:50153 http://www.chembase.cn/molecule-50153.html