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SMILES: c1(cnc2c(c1O)OCCO2)I Canonical SMILES: Ic1cnc2c(c1O)OCCO2 InChI: InChI=1S/C7H6INO3/c8-4-3-9-7-6(5(4)10)11-1-2-12-7/h3H,1-2H2,(H,9,10) InChIKey: XDMBVVQYAZAKHH-UHFFFAOYSA-N
CBID:54466 http://www.chembase.cn/molecule-54466.html