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SMILES: COc1c(Br)cc(OC)c2c1CC2CN Canonical SMILES: COc1c(Br)cc(c2c1CC2CN)OC InChI: InChI=1S/C11H14BrNO2/c1-14-9-4-8(12)11(15-2)7-3-6(5-13)10(7)9/h4,6H,3,5,13H2,1-2H3 InChIKey: MPBCKKVERDTCEL-UHFFFAOYSA-N
CBID:129722 http://www.chembase.cn/molecule-129722.html