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SMILES: n1c(ccc(c1)Br)C(=O)NCCC Canonical SMILES: CCCNC(=O)c1ccc(cn1)Br InChI: InChI=1S/C9H11BrN2O/c1-2-5-11-9(13)8-4-3-7(10)6-12-8/h3-4,6H,2,5H2,1H3,(H,11,13) InChIKey: DNTKQEUMMIRYDJ-UHFFFAOYSA-N
CBID:75750 http://www.chembase.cn/molecule-75750.html