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SMILES: N#CCC(=O)c1ccc(cc1)CCC Canonical SMILES: CCCc1ccc(cc1)C(=O)CC#N InChI: InChI=1S/C12H13NO/c1-2-3-10-4-6-11(7-5-10)12(14)8-9-13/h4-7H,2-3,8H2,1H3 InChIKey: KVXGLAIRWBFDBH-UHFFFAOYSA-N
CBID:230953 http://www.chembase.cn/molecule-230953.html