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SMILES: N1(C[C@@H]([C@@H](C1)c1c(cccc1)Cl)CBr)C(=O)OC(C)(C)C Canonical SMILES: BrC[C@H]1CN(C[C@H]1c1ccccc1Cl)C(=O)OC(C)(C)C InChI: InChI=1S/C16H21BrClNO2/c1-16(2,3)21-15(20)19-9-11(8-17)13(10-19)12-6-4-5-7-14(12)18/h4-7,11,13H,8-10H2,1-3H3/t11-,13+/m0/s1 InChIKey: MSQNNTHIMOUAJA-WCQYABFASA-N
CBID:799961 http://www.chembase.cn/molecule-799961.html