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SMILES: c1(c(cc(c(c1)Br)N)OC)C(=O)O Canonical SMILES: COc1cc(N)c(cc1C(=O)O)Br InChI: InChI=1S/C8H8BrNO3/c1-13-7-3-6(10)5(9)2-4(7)8(11)12/h2-3H,10H2,1H3,(H,11,12) InChIKey: WHXLHIGUTBQVOF-UHFFFAOYSA-N
CBID:40839 http://www.chembase.cn/molecule-40839.html