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SMILES: [nH]1c(ncc1Br)C(=O)OCC Canonical SMILES: CCOC(=O)c1ncc([nH]1)Br InChI: InChI=1S/C6H7BrN2O2/c1-2-11-6(10)5-8-3-4(7)9-5/h3H,2H2,1H3,(H,8,9) InChIKey: ZCIMIBOKGAGKRV-UHFFFAOYSA-N
CBID:798836 http://www.chembase.cn/molecule-798836.html