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SMILES: C(=O)(CC(=O)C)Nc1ccc(Br)cc1 Canonical SMILES: O=C(Nc1ccc(cc1)Br)CC(=O)C InChI: InChI=1S/C10H10BrNO2/c1-7(13)6-10(14)12-9-4-2-8(11)3-5-9/h2-5H,6H2,1H3,(H,12,14) InChIKey: JIOJEVGOXBFZDM-UHFFFAOYSA-N
CBID:229120 http://www.chembase.cn/molecule-229120.html