3- [双[3-(Boc-氨基)丙基]胺]丙酸甲酯结构式

3- [双[3-(Boc-氨基)丙基]胺]丙酸甲酯
中文名称:3- [双[3-(Boc-氨基)丙基]胺]丙酸甲酯
英文名称:Methyl 3-[Bis[3-(Boc-amino)propyl]amino]propanoate
CAS No.:1442656-30-5
分子式:C20H39N3O6 分子量:417.5402
3- [双[3-(Boc-氨基)丙基]胺]丙酸甲酯 数据
Mol:
3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5263   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6603    1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.5263    4.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5263    3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5263    3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3660   -2.1340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3660   -3.8660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2583   -3.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1 18  1  0  0  0  0
  1 21  1  0  0  0  0
  2 19  1  0  0  0  0
  2 22  1  0  0  0  0
  3 20  1  0  0  0  0
  3 29  1  0  0  0  0
  4 20  2  0  0  0  0
  5 21  2  0  0  0  0
  6 22  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  7 12  1  0  0  0  0
  8 15  1  0  0  0  0
  8 21  1  0  0  0  0
  9 16  1  0  0  0  0
  9 22  1  0  0  0  0
 10 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12 17  1  0  0  0  0
 13 15  1  0  0  0  0
 14 16  1  0  0  0  0
 17 20  1  0  0  0  0
 18 23  1  0  0  0  0
 18 24  1  0  0  0  0
 18 25  1  0  0  0  0
 19 26  1  0  0  0  0
 19 27  1  0  0  0  0
 19 28  1  0  0  0  0
M  END                                
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3- [双[3-(Boc-氨基)丙基]胺]丙酸甲酯 Smile 编码:
O(C(NCCCN(CCC(=O)OC)CCCNC(=O)OC(C)(C)C)=O)C(C)(C)C
3- [双[3-(Boc-氨基)丙基]胺]丙酸甲酯 InChi 编码:
1S/C20H39N3O6/c1-19(2,3)28-17(25)21-11-8-13-23(15-10-16(24)27-7)14-9-12-22-18(26)29-20(4,5)6/h8-15H2,1-7H3,(H,21,25)(H,22,26)
3- [双[3-(Boc-氨基)丙基]胺]丙酸甲酯 InChiKey 编码:
HMOWUXGUTGEJFZ-UHFFFAOYSA-N