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SMILES: c1(c(c2cc3c(OCCO3)cc2)c([nH]n1)C)c1c(cc(c(c1)CCC)O)O Canonical SMILES: CCCc1cc(c(cc1O)O)c1n[nH]c(c1c1ccc2c(c1)OCCO2)C InChI: InChI=1S/C21H22N2O4/c1-3-4-13-9-15(17(25)11-16(13)24)21-20(12(2)22-23-21)14-5-6-18-19(10-14)27-8-7-26-18/h5-6,9-11,24-25H,3-4,7-8H2,1-2H3,(H,22,23) InChIKey: FOUMOIACEBZYPT-UHFFFAOYSA-N
CBID:185239 http://www.chembase.cn/molecule-185239.html