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SMILES: c1(cncc(c1)I)OC Canonical SMILES: COc1cc(I)cnc1 InChI: InChI=1S/C6H6INO/c1-9-6-2-5(7)3-8-4-6/h2-4H,1H3 InChIKey: UJKNMHKWMSUTME-UHFFFAOYSA-N
CBID:22337 http://www.chembase.cn/molecule-22337.html