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SMILES: C(=O)(CC(=O)C)Nc1cc(Br)ccc1 Canonical SMILES: O=C(Nc1cccc(c1)Br)CC(=O)C InChI: InChI=1S/C10H10BrNO2/c1-7(13)5-10(14)12-9-4-2-3-8(11)6-9/h2-4,6H,5H2,1H3,(H,12,14) InChIKey: RSQFOIHPOUSQTO-UHFFFAOYSA-N
CBID:272981 http://www.chembase.cn/molecule-272981.html