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SMILES: N#Cc1ccc(SCC(=O)O)cc1 Canonical SMILES: N#Cc1ccc(cc1)SCC(=O)O InChI: InChI=1S/C9H7NO2S/c10-5-7-1-3-8(4-2-7)13-6-9(11)12/h1-4H,6H2,(H,11,12) InChIKey: KUQOJEIRBXLJNM-UHFFFAOYSA-N
CBID:270271 http://www.chembase.cn/molecule-270271.html