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SMILES: N1(CCC(=O)CC1)c1ncc(cn1)Br Canonical SMILES: O=C1CCN(CC1)c1ncc(cn1)Br InChI: InChI=1S/C9H10BrN3O/c10-7-5-11-9(12-6-7)13-3-1-8(14)2-4-13/h5-6H,1-4H2 InChIKey: YMCZXCIBGNKAQX-UHFFFAOYSA-N
CBID:66608 http://www.chembase.cn/molecule-66608.html