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SMILES: [nH]1nc(c2cc(ccc12)Br)C=O Canonical SMILES: Brc1cc2c(C=O)n[nH]c2cc1 InChI: InChI=1S/C8H5BrN2O/c9-5-1-2-7-6(3-5)8(4-12)11-10-7/h1-4H,(H,10,11) InChIKey: ILGTYHMEQSSHFG-UHFFFAOYSA-N
CBID:53067 http://www.chembase.cn/molecule-53067.html