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SMILES: c12[nH]c(nc1cccc2)CCBr Canonical SMILES: BrCCc1nc2c([nH]1)cccc2 InChI: InChI=1S/C9H9BrN2/c10-6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6H2,(H,11,12) InChIKey: UVKUFRWLIJUYHS-UHFFFAOYSA-N
CBID:798616 http://www.chembase.cn/molecule-798616.html