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SMILES: c1(cccc(c1)[C@@H]1CNCCC1)S(=O)(=O)C.C(C(O)C(=O)O)(O)C(=O)O Canonical SMILES: CS(=O)(=O)c1cccc(c1)[C@H]1CCCNC1.OC(=O)C(C(C(=O)O)O)O InChI: InChI=1S/C12H17NO2S.C4H6O6/c1-16(14,15)12-6-2-4-10(8-12)11-5-3-7-13-9-11;5-1(3(7)8)2(6)4(9)10/h2,4,6,8,11,13H,3,5,7,9H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t11-;/m0./s1 InChIKey: JUXRLGRCXHOPLH-MERQFXBCSA-N
CBID:172596 http://www.chembase.cn/molecule-172596.html