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SMILES: n1c2n(cc1c1ccc(cc1)OC)cccn2.Br Canonical SMILES: COc1ccc(cc1)c1cn2c(n1)nccc2.Br InChI: InChI=1S/C13H11N3O.BrH/c1-17-11-5-3-10(4-6-11)12-9-16-8-2-7-14-13(16)15-12;/h2-9H,1H3;1H InChIKey: WGESMMXWJJNMFW-UHFFFAOYSA-N
CBID:73465 http://www.chembase.cn/molecule-73465.html