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SMILES: B(c1cccc(c1)C(C)CN(CNCC)C=O)(O)O.Cl Canonical SMILES: CCNCN(CC(c1cccc(c1)B(O)O)C)C=O.Cl InChI: InChI=1S/C13H21BN2O3.ClH/c1-3-15-9-16(10-17)8-11(2)12-5-4-6-13(7-12)14(18)19;/h4-7,10-11,15,18-19H,3,8-9H2,1-2H3;1H InChIKey: TWKWNMGUZPHAAN-UHFFFAOYSA-N
CBID:298405 http://www.chembase.cn/molecule-298405.html