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SMILES: C1CC(CCC1)(C(=O)OC)C#N Canonical SMILES: COC(=O)C1(CCCCC1)C#N InChI: InChI=1S/C9H13NO2/c1-12-8(11)9(7-10)5-3-2-4-6-9/h2-6H2,1H3 InChIKey: PVFHKRCUWUPRFA-UHFFFAOYSA-N
CBID:43448 http://www.chembase.cn/molecule-43448.html