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SMILES: c\1(=C(\C#N)/C(=O)CCl)/[nH]c(=O)c2c([nH]1)cccc2 Canonical SMILES: ClCC(=O)/C(=c/1\[nH]c(=O)c2c([nH]1)cccc2)/C#N InChI: InChI=1S/C12H8ClN3O2/c13-5-10(17)8(6-14)11-15-9-4-2-1-3-7(9)12(18)16-11/h1-4,15H,5H2,(H,16,18)/b11-8- InChIKey: SOEASRUCSGGRTM-FLIBITNWSA-N
CBID:250240 http://www.chembase.cn/molecule-250240.html