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SMILES: c1cnc(c(c1)I)OC Canonical SMILES: COc1ncccc1I InChI: InChI=1S/C6H6INO/c1-9-6-5(7)3-2-4-8-6/h2-4H,1H3 InChIKey: BXCHJERCAUZLOE-UHFFFAOYSA-N
CBID:15485 http://www.chembase.cn/molecule-15485.html