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SMILES: c1c(nccc1Br)OC Canonical SMILES: COc1cc(Br)ccn1 InChI: InChI=1S/C6H6BrNO/c1-9-6-4-5(7)2-3-8-6/h2-4H,1H3 InChIKey: YFTGMMXMLPTTAY-UHFFFAOYSA-N
CBID:64384 http://www.chembase.cn/molecule-64384.html