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SMILES: c1(c(nccc1I)OC)C=O Canonical SMILES: COc1nccc(c1C=O)I InChI: InChI=1S/C7H6INO2/c1-11-7-5(4-10)6(8)2-3-9-7/h2-4H,1H3 InChIKey: GNBKAOHTTIVAMT-UHFFFAOYSA-N
CBID:50756 http://www.chembase.cn/molecule-50756.html