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SMILES: c1cccc(c1)S(=O)(=O)OCCC Canonical SMILES: CCCOS(=O)(=O)c1ccccc1 InChI: InChI=1S/C9H12O3S/c1-2-8-12-13(10,11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3 InChIKey: OCNPXKLQSGAGKT-UHFFFAOYSA-N
CBID:177033 http://www.chembase.cn/molecule-177033.html