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SMILES: C1(=O)Nc2c(C1N)cc(cc2)Br Canonical SMILES: O=C1Nc2c(C1N)cc(cc2)Br InChI: InChI=1S/C8H7BrN2O/c9-4-1-2-6-5(3-4)7(10)8(12)11-6/h1-3,7H,10H2,(H,11,12) InChIKey: ZPTWXWQOQKYHCZ-UHFFFAOYSA-N
CBID:308272 http://www.chembase.cn/molecule-308272.html