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SMILES: [C@H]1(C(=O)N2[C@@H]1SC([C@@H]2C(=O)[O-])(C)C)NC(=O)C(c1c(cccc1)Br)C(=O)[O-].[Na+].[Na+] Canonical SMILES: O=C(C(c1ccccc1Br)C(=O)[O-])N[C@@H]1C(=O)N2[C@@H]1SC([C@@H]2C(=O)[O-])(C)C.[Na+].[Na+] InChI: InChI=1S/C17H17BrN2O6S.2Na/c1-17(2)11(16(25)26)20-13(22)10(14(20)27-17)19-12(21)9(15(23)24)7-5-3-4-6-8(7)18;;/h3-6,9-11,14H,1-2H3,(H,19,21)(H,23,24)(H,25,26);;/q;2*+1/p-2/t9?,10-,11+,14-;;/m1../s1 InChIKey: BGHMDZLUPBPVJI-YCAHSCEMSA-L
CBID:162787 http://www.chembase.cn/molecule-162787.html