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SMILES: O=C1Nc2c(C1)cc(nc2)Br Canonical SMILES: O=C1Nc2c(C1)cc(nc2)Br InChI: InChI=1S/C7H5BrN2O/c8-6-1-4-2-7(11)10-5(4)3-9-6/h1,3H,2H2,(H,10,11) InChIKey: ITTBVIMPQOKVJZ-UHFFFAOYSA-N
CBID:294792 http://www.chembase.cn/molecule-294792.html