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SMILES: n1(c2c(nc1)CCCC2)CC(=O)O Canonical SMILES: OC(=O)Cn1cnc2c1CCCC2 InChI: InChI=1S/C9H12N2O2/c12-9(13)5-11-6-10-7-3-1-2-4-8(7)11/h6H,1-5H2,(H,12,13) InChIKey: XJDAVGNSIUIIGA-UHFFFAOYSA-N
CBID:247079 http://www.chembase.cn/molecule-247079.html