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SMILES: c12C3(CNc1ccc(c2)Br)CCCC3 Canonical SMILES: Brc1ccc2c(c1)C1(CCCC1)CN2 InChI: InChI=1S/C12H14BrN/c13-9-3-4-11-10(7-9)12(8-14-11)5-1-2-6-12/h3-4,7,14H,1-2,5-6,8H2 InChIKey: XAIVBUKCMJRNHM-UHFFFAOYSA-N
CBID:275879 http://www.chembase.cn/molecule-275879.html