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SMILES: O.O=CC(=O)c1ccc(cc1)SC Canonical SMILES: CSc1ccc(cc1)C(=O)C=O.O InChI: InChI=1S/C9H8O2S.H2O/c1-12-8-4-2-7(3-5-8)9(11)6-10;/h2-6H,1H3;1H2 InChIKey: WKXASWCTJZBFOG-UHFFFAOYSA-N
CBID:806204 http://www.chembase.cn/molecule-806204.html