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SMILES: c1(C(=O)O)cc(c(c(c1)C)N)Br Canonical SMILES: OC(=O)c1cc(C)c(c(c1)Br)N InChI: InChI=1S/C8H8BrNO2/c1-4-2-5(8(11)12)3-6(9)7(4)10/h2-3H,10H2,1H3,(H,11,12) InChIKey: PVGKGOMPWNLCEV-UHFFFAOYSA-N
CBID:308386 http://www.chembase.cn/molecule-308386.html