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SMILES: C(=O)(c1ccc(cc1)CCCC)C Canonical SMILES: CCCCc1ccc(cc1)C(=O)C InChI: InChI=1S/C12H16O/c1-3-4-5-11-6-8-12(9-7-11)10(2)13/h6-9H,3-5H2,1-2H3 InChIKey: MQESVSITPLILCO-UHFFFAOYSA-N
CBID:8550 http://www.chembase.cn/molecule-8550.html