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SMILES: c1(c(C(=O)O)cccn1)Sc1ccc(Br)cc1 Canonical SMILES: Brc1ccc(cc1)Sc1ncccc1C(=O)O InChI: InChI=1S/C12H8BrNO2S/c13-8-3-5-9(6-4-8)17-11-10(12(15)16)2-1-7-14-11/h1-7H,(H,15,16) InChIKey: VEGJCWLQSIOCCF-UHFFFAOYSA-N
CBID:234781 http://www.chembase.cn/molecule-234781.html