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SMILES: n1n(cc(c1)Cl)CCC(=O)O Canonical SMILES: OC(=O)CCn1cc(cn1)Cl InChI: InChI=1S/C6H7ClN2O2/c7-5-3-8-9(4-5)2-1-6(10)11/h3-4H,1-2H2,(H,10,11) InChIKey: JFKQKQVXRVGXGC-UHFFFAOYSA-N
CBID:33642 http://www.chembase.cn/molecule-33642.html