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SMILES: n1(c(c(c(n1)C)Cl)C)CC(=O)O Canonical SMILES: OC(=O)Cn1nc(c(c1C)Cl)C InChI: InChI=1S/C7H9ClN2O2/c1-4-7(8)5(2)10(9-4)3-6(11)12/h3H2,1-2H3,(H,11,12) InChIKey: PSXIFNAQYKUAOF-UHFFFAOYSA-N
CBID:16474 http://www.chembase.cn/molecule-16474.html