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SMILES: N1C[C@@H]([C@H](C1)c1c(cccc1)Br)C(=O)O Canonical SMILES: OC(=O)[C@H]1CNC[C@@H]1c1ccccc1Br InChI: InChI=1S/C11H12BrNO2/c12-10-4-2-1-3-7(10)8-5-13-6-9(8)11(14)15/h1-4,8-9,13H,5-6H2,(H,14,15)/t8-,9+/m1/s1 InChIKey: YRGSCRAWFNNSIP-BDAKNGLRSA-N
CBID:800001 http://www.chembase.cn/molecule-800001.html