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SMILES: c1cc2c(cc1Br)c(cc(n2)CCC)NC(=O)OC(C)(C)C Canonical SMILES: CCCc1cc(NC(=O)OC(C)(C)C)c2c(n1)ccc(c2)Br InChI: InChI=1S/C17H21BrN2O2/c1-5-6-12-10-15(20-16(21)22-17(2,3)4)13-9-11(18)7-8-14(13)19-12/h7-10H,5-6H2,1-4H3,(H,19,20,21) InChIKey: VMAQLZQFIHWVET-UHFFFAOYSA-N
CBID:805003 http://www.chembase.cn/molecule-805003.html