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SMILES: C1(C(=O)O)(C#N)CCCCC1 Canonical SMILES: N#CC1(CCCCC1)C(=O)O InChI: InChI=1S/C8H11NO2/c9-6-8(7(10)11)4-2-1-3-5-8/h1-5H2,(H,10,11) InChIKey: ISEJXQAAWBXLGB-UHFFFAOYSA-N
CBID:263533 http://www.chembase.cn/molecule-263533.html