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SMILES: n1cnc2c(c1Cl)c(c[nH]2)I Canonical SMILES: Ic1c[nH]c2c1c(Cl)ncn2 InChI: InChI=1S/C6H3ClIN3/c7-5-4-3(8)1-9-6(4)11-2-10-5/h1-2H,(H,9,10,11) InChIKey: CBWBJFJMNBPWAL-UHFFFAOYSA-N
CBID:54407 http://www.chembase.cn/molecule-54407.html