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SMILES: c1(cnc(cc1)CCOc1ccc(cc1)Br)CC Canonical SMILES: CCc1ccc(nc1)CCOc1ccc(cc1)Br InChI: InChI=1S/C15H16BrNO/c1-2-12-3-6-14(17-11-12)9-10-18-15-7-4-13(16)5-8-15/h3-8,11H,2,9-10H2,1H3 InChIKey: DOZJKXJBAFQCPO-UHFFFAOYSA-N
CBID:163003 http://www.chembase.cn/molecule-163003.html