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SMILES: O=Cc1cnc2cc(C)c(Br)cn12 Canonical SMILES: O=Cc1cnc2n1cc(Br)c(c2)C InChI: InChI=1S/C9H7BrN2O/c1-6-2-9-11-3-7(5-13)12(9)4-8(6)10/h2-5H,1H3 InChIKey: PAHPNWWTCINFQJ-UHFFFAOYSA-N
CBID:292015 http://www.chembase.cn/molecule-292015.html