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SMILES: c1cc(cc(c1)CCC(=O)O)I Canonical SMILES: OC(=O)CCc1cccc(c1)I InChI: InChI=1S/C9H9IO2/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6H,4-5H2,(H,11,12) InChIKey: GGLXNAUNBQJVTF-UHFFFAOYSA-N
CBID:10623 http://www.chembase.cn/molecule-10623.html