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SMILES: O=C(c1cc(ccc1)Br)NCCO Canonical SMILES: OCCNC(=O)c1cccc(c1)Br InChI: InChI=1S/C9H10BrNO2/c10-8-3-1-2-7(6-8)9(13)11-4-5-12/h1-3,6,12H,4-5H2,(H,11,13) InChIKey: UEGSPYYXSPOOET-UHFFFAOYSA-N
CBID:75755 http://www.chembase.cn/molecule-75755.html