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SMILES: N1(c2nccc3c2cco3)CCCNCC1 Canonical SMILES: N1CCCN(CC1)c1nccc2c1cco2 InChI: InChI=1S/C12H15N3O/c1-4-13-6-8-15(7-1)12-10-3-9-16-11(10)2-5-14-12/h2-3,5,9,13H,1,4,6-8H2 InChIKey: JGVLLHBTSVQMHS-UHFFFAOYSA-N
CBID:77279 http://www.chembase.cn/molecule-77279.html