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SMILES: s1c(c(c(c1)Br)N)C(=O)O Canonical SMILES: OC(=O)c1scc(c1N)Br InChI: InChI=1S/C5H4BrNO2S/c6-2-1-10-4(3(2)7)5(8)9/h1H,7H2,(H,8,9) InChIKey: NKHTXVSQLUINPY-UHFFFAOYSA-N
CBID:814521 http://www.chembase.cn/molecule-814521.html