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SMILES: N1(c2ncc(cc2)Br)CCNCC1 Canonical SMILES: Brc1ccc(nc1)N1CCNCC1 InChI: InChI=1S/C9H12BrN3/c10-8-1-2-9(12-7-8)13-5-3-11-4-6-13/h1-2,7,11H,3-6H2 InChIKey: UBJBNGGYLBVCJF-UHFFFAOYSA-N
CBID:92126 http://www.chembase.cn/molecule-92126.html