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SMILES: c1(ncc2c(c1)cc([nH]2)C(=O)O)Br Canonical SMILES: Brc1ncc2c(c1)cc([nH]2)C(=O)O InChI: InChI=1S/C8H5BrN2O2/c9-7-2-4-1-5(8(12)13)11-6(4)3-10-7/h1-3,11H,(H,12,13) InChIKey: NNWNNQTUZYVQRK-UHFFFAOYSA-N
CBID:52837 http://www.chembase.cn/molecule-52837.html