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SMILES: n1cccc2c(=O)[nH]cc(c12)Br Canonical SMILES: Brc1c[nH]c(=O)c2c1nccc2 InChI: InChI=1S/C8H5BrN2O/c9-6-4-11-8(12)5-2-1-3-10-7(5)6/h1-4H,(H,11,12) InChIKey: WYXKOZHBOLUXGU-UHFFFAOYSA-N
CBID:29702 http://www.chembase.cn/molecule-29702.html