主记录
CID11703079
- CAS
- 497224-04-1
- PubChem CID
- 11703079
- SMILES
- CC(C)CN1CCC/C(=C\C2=C1C=CC(=C2)Br)/C(=O)OC
- 分子式
- C17H22BrNO2
- 分子量
- 352.272
- 精确分子量
- 351.0834
- InChI
- InChI=1S/C17H22BrNO2/c1-12(2)11-19-8-4-5-13(17(20)21-3)9-14-10-15(18)6-7-16(14)19/h6-7,9-10,12H,4-5,8,11H2,1-3H3/b13-9+
- InChIKey
- ILNKRZDWIOUWKN-UKTHLTGXSA-N
- LogP
- 4.2617
- TPSA
- 29.54
名称与别名
- SCHEMBL3177367
- CID11703079
- 497224-04-1
- CS-0042434
- A1087368
- Methyl 8-bromo-1-(2-methylpropyl)-1,2,3,4-tetrahydro-1-benzazocine-5-carboxylate
- (E)-Methyl 8-bromo-1-isobutyl-1,2,3,4-tetrahydrobenzo[b]azocine-5-carboxylate
- methyl (5E)-8-bromo-1-isobutyl-3,4-dihydro-2H-1-benzazocine-5-carboxylate
- Methyl 8-bromo-1-isobutyl-1,2,3,4-tetrahydrobenzo[b]azocine-5-carboxylate
- Methyl8-bromo-1-isobutyl-1,2,3,4-tetrahydrobenzo[b]azocine-5-carboxylate
- methyl (5E)-8-bromo-1-(2-methylpropyl)-3,4-dihydro-2H-1-benzazocine-5-carboxylate
- methyl 8-bromo-1-(2-methylpropyl)-3,4-dihydro-2H-1-benzazocine-5-carboxylate
- Methyl (6E)-10-bromo-2-(2-methylpropyl)-2-azabicyclo[6.4.0]dodeca-6,9,11,13-tetraene-6-carboxylate