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SMILES: n1(ncc(c1)Cl)CC(C(=O)O)C Canonical SMILES: CC(C(=O)O)Cn1cc(cn1)Cl InChI: InChI=1S/C7H9ClN2O2/c1-5(7(11)12)3-10-4-6(8)2-9-10/h2,4-5H,3H2,1H3,(H,11,12) InChIKey: KQFNSKFMSFIBEY-UHFFFAOYSA-N
CBID:31313 http://www.chembase.cn/molecule-31313.html