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SMILES: CC(c1ccccc1)(C(=O)O)O.CC(c1ccccc1)(C(=O)O)O.O Canonical SMILES: OC(=O)C(c1ccccc1)(O)C.OC(=O)C(c1ccccc1)(O)C.O InChI: InChI=1S/2C9H10O3.H2O/c2*1-9(12,8(10)11)7-5-3-2-4-6-7;/h2*2-6,12H,1H3,(H,10,11);1H2 InChIKey: BCZRQUYXNLVFOZ-UHFFFAOYSA-N
CBID:139002 http://www.chembase.cn/molecule-139002.html