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SMILES: O=C(c1cc2ncc(n2cc1)Br)OC Canonical SMILES: COC(=O)c1ccn2c(c1)ncc2Br InChI: InChI=1S/C9H7BrN2O2/c1-14-9(13)6-2-3-12-7(10)5-11-8(12)4-6/h2-5H,1H3 InChIKey: VFFFBWRUZMAHFS-UHFFFAOYSA-N
CBID:89635 http://www.chembase.cn/molecule-89635.html