tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate结构式

tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate
中文名称:tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate
英文名称:tert-butyl N-[(3R,5S)-5-(trifluoromethyl)-3-piperidyl]carbamate
CAS No.:1523530-57-5
分子式:C11H19F3N2O2 分子量:268.275973558426
tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate 数据
Mol:
-0.6230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4641   -0.6230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660    0.8770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1962    0.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9282    0.3770    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7942   -0.1230    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4282    1.2430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4282   -0.4890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  1  0
  2 13  1  0
  3 13  1  0
  4 14  1  0
  4 15  1  0
  5 14  2  0
  6 11  1  0
  6 12  1  0
  9  7  1  1
  7 14  1  0
  8 10  1  0
  8 11  1  0
  8 13  1  1
  9 10  1  0
  9 12  1  0
 15 16  1  0
 15 17  1  0
 15 18  1  0
M  END                                
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tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate Smile 编码:
FC([C@@H]1CNC[C@@H](C1)NC(=O)OC(C)(C)C)(F)F
tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate InChi 编码:
1S/C11H19F3N2O2/c1-10(2,3)18-9(17)16-8-4-7(5-15-6-8)11(12,13)14/h7-8,15H,4-6H2,1-3H3,(H,16,17)/t7-,8+/m0/s1
tert-butyl N-[(3R,5S)-5-(trifluoromethyl)piperidin-3-yl]carbamate InChiKey 编码:
CUNVTZVWJLBPQS-JGVFFNPUSA-N