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SMILES: B(c1ccc(c(c1)C)CO)(O)O.CCN=O.C=S=O Canonical SMILES: OCc1ccc(cc1C)B(O)O.CCN=O.C=S=O InChI: InChI=1S/C8H11BO3.C2H5NO.CH2OS/c1-6-4-8(9(11)12)3-2-7(6)5-10;1-2-3-4;1-3-2/h2-4,10-12H,5H2,1H3;2H2,1H3;1H2 InChIKey: NUBSVRMGBDSUIG-UHFFFAOYSA-N
CBID:298243 http://www.chembase.cn/molecule-298243.html