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SMILES: c1(C(=O)NC2CC2)oc(cc1)Br Canonical SMILES: O=C(c1ccc(o1)Br)NC1CC1 InChI: InChI=1S/C8H8BrNO2/c9-7-4-3-6(12-7)8(11)10-5-1-2-5/h3-5H,1-2H2,(H,10,11) InChIKey: PMSFSZXTIBYUBX-UHFFFAOYSA-N
CBID:311931 http://www.chembase.cn/molecule-311931.html