主记录
CID11691237
- CAS
- 497224-05-2
- PubChem CID
- 11691237
- SMILES
- CCCCOCCOC1=CC=C(C=C1)C2=CC/3=C(C=C2)N(CCC/C(=C3)/C(=O)OC)CC(C)C
- 分子式
- C29H39NO4
- 分子量
- 465.634
- 精确分子量
- 465.2879
- InChI
- InChI=1S/C29H39NO4/c1-5-6-16-33-17-18-34-27-12-9-23(10-13-27)24-11-14-28-26(19-24)20-25(29(31)32-4)8-7-15-30(28)21-22(2)3/h9-14,19-20,22H,5-8,15-18,21H2,1-4H3/b25-20+
- InChIKey
- PDFONMQPRVHLQN-LKUDQCMESA-N
- LogP
- 6.3617
- TPSA
- 48
名称与别名
- SCHEMBL3173672
- CID11691237
- CID 11691237
- 497224-05-2
- methyl (E)-8-(4-(2-butoxyethoxy)phenyl)-1-isobutyl-1,2,3,4-tetrahydrobenzo[b]azocine-5-carboxylate
- methyl (5E)-8-[4-(2-butoxyethoxy)phenyl]-1-(2-methylpropyl)-1,2,3,4-tetrahydro-1-benzazocine-5-carboxylate