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SMILES: c1(cc(ccn1)Br)C=O Canonical SMILES: Brc1cc(C=O)ncc1 InChI: InChI=1S/C6H4BrNO/c7-5-1-2-8-6(3-5)4-9/h1-4H InChIKey: CKVQWOKUEZYWRQ-UHFFFAOYSA-N
CBID:68110 http://www.chembase.cn/molecule-68110.html