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SMILES: c1(cnc(nc1)CCl)C=O Canonical SMILES: ClCc1ncc(cn1)C=O InChI: InChI=1S/C6H5ClN2O/c7-1-6-8-2-5(4-10)3-9-6/h2-4H,1H2 InChIKey: SHQDOUUPDCKQPM-UHFFFAOYSA-N
CBID:803885 http://www.chembase.cn/molecule-803885.html