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SMILES: s1cc(c2cc(ccc12)Cl)C=O Canonical SMILES: O=Cc1csc2c1cc(Cl)cc2 InChI: InChI=1S/C9H5ClOS/c10-7-1-2-9-8(3-7)6(4-11)5-12-9/h1-5H InChIKey: JDEWSTAKAXZTOX-UHFFFAOYSA-N
CBID:86400 http://www.chembase.cn/molecule-86400.html