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SMILES: c1c(ccc(c1)C(O)CNCCCC)O.S(=O)(=O)(O)O Canonical SMILES: OS(=O)(=O)O.CCCCNCC(c1ccc(cc1)O)O InChI: InChI=1S/C12H19NO2.H2O4S/c1-2-3-8-13-9-12(15)10-4-6-11(14)7-5-10;1-5(2,3)4/h4-7,12-15H,2-3,8-9H2,1H3;(H2,1,2,3,4) InChIKey: LHQHLXHNHWARAM-UHFFFAOYSA-N
CBID:161111 http://www.chembase.cn/molecule-161111.html