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SMILES: c1(=O)cc(ccn1CC)C(=O)O Canonical SMILES: CCn1ccc(cc1=O)C(=O)O InChI: InChI=1S/C8H9NO3/c1-2-9-4-3-6(8(11)12)5-7(9)10/h3-5H,2H2,1H3,(H,11,12) InChIKey: MZLMUTMYNUZZTC-UHFFFAOYSA-N
CBID:308529 http://www.chembase.cn/molecule-308529.html