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SMILES: C(=O)(C(Oc1ccccc1)CC)O Canonical SMILES: CCC(C(=O)O)Oc1ccccc1 InChI: InChI=1S/C10H12O3/c1-2-9(10(11)12)13-8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,11,12) InChIKey: TVSPPYGAFOVROT-UHFFFAOYSA-N
CBID:21735 http://www.chembase.cn/molecule-21735.html