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SMILES: O=S(=O)(c1cc(cc(c1)Br)C)NCC Canonical SMILES: CCNS(=O)(=O)c1cc(C)cc(c1)Br InChI: InChI=1S/C9H12BrNO2S/c1-3-11-14(12,13)9-5-7(2)4-8(10)6-9/h4-6,11H,3H2,1-2H3 InChIKey: DMARLJQSKFGCTP-UHFFFAOYSA-N
CBID:75821 http://www.chembase.cn/molecule-75821.html