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SMILES: O=C(O)CCc1ccc[nH]1 Canonical SMILES: OC(=O)CCc1ccc[nH]1 InChI: InChI=1S/C7H9NO2/c9-7(10)4-3-6-2-1-5-8-6/h1-2,5,8H,3-4H2,(H,9,10) InChIKey: XDNDSAQVXNZKGP-UHFFFAOYSA-N
CBID:294347 http://www.chembase.cn/molecule-294347.html