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SMILES: Brc1cc(cc(c1)CC#N)F Canonical SMILES: N#CCc1cc(F)cc(c1)Br InChI: InChI=1S/C8H5BrFN/c9-7-3-6(1-2-11)4-8(10)5-7/h3-5H,1H2 InChIKey: FSKMLBLIAOVQCF-UHFFFAOYSA-N
CBID:100609 http://www.chembase.cn/molecule-100609.html