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SMILES: c1(c(=N)n2c(cc1c1ccc(C(=O)O)cc1)c1c(cc3c(c1)OCO3)CC2)C#N Canonical SMILES: N#Cc1c(cc2n(c1=N)CCc1c2cc2OCOc2c1)c1ccc(cc1)C(=O)O InChI: InChI=1S/C22H15N3O4/c23-10-17-15(12-1-3-13(4-2-12)22(26)27)8-18-16-9-20-19(28-11-29-20)7-14(16)5-6-25(18)21(17)24/h1-4,7-9,24H,5-6,11H2,(H,26,27) InChIKey: WDQSOOXHCHJQQS-UHFFFAOYSA-N
CBID:214160 http://www.chembase.cn/molecule-214160.html