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SMILES: C(=O)(C(CN)Cc1cc(ccc1)Br)O Canonical SMILES: NCC(C(=O)O)Cc1cccc(c1)Br InChI: InChI=1S/C10H12BrNO2/c11-9-3-1-2-7(5-9)4-8(6-12)10(13)14/h1-3,5,8H,4,6,12H2,(H,13,14) InChIKey: XHOJQDSCSICOOX-UHFFFAOYSA-N
CBID:809855 http://www.chembase.cn/molecule-809855.html