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SMILES: C1(CC1)(C(=O)O)c1cc(ncc1)Br Canonical SMILES: Brc1nccc(c1)C1(CC1)C(=O)O InChI: InChI=1S/C9H8BrNO2/c10-7-5-6(1-4-11-7)9(2-3-9)8(12)13/h1,4-5H,2-3H2,(H,12,13) InChIKey: IPHJRNBPNWSYIK-UHFFFAOYSA-N
CBID:814867 http://www.chembase.cn/molecule-814867.html