Isoxazolidine,3-(1H-imidazol-1-ylmethyl)-2-methyl-3,5-diphenyl-, cis- (9CI)结构式

Isoxazolidine,3-(1H-imidazol-1-ylmethyl)-2-methyl-3,5-diphenyl-, cis- (9CI)
英文名称:Isoxazolidine,3-(1H-imidazol-1-ylmethyl)-2-methyl-3,5-diphenyl-, cis- (9CI)
CAS No.:113614-46-3
分子式:C20H21N3O 分子量:319.40024
Isoxazolidine,3-(1H-imidazol-1-ylmethyl)-2-methyl-3,5-diphenyl-, cis- (9CI) 数据
Mol:
 0
    7.5852    5.4232    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0920    5.9084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0920    7.4784    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5852    7.9635    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5080    6.6934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5346    1.2702    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4575    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9646    1.2702    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  7  4  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  1  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 10  1  0  0  0  0
  9 16  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 17  1  0  0  0  0
  9 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  1  0  0  0  0
 24  7  1  0  0  0  0
M  END                                
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Isoxazolidine,3-(1H-imidazol-1-ylmethyl)-2-methyl-3,5-diphenyl-, cis- (9CI) Smile 编码:
C1C=CC([C@H]2ON(C)[C@](CN3C=CN=C3)(C3C=CC=CC=3)C2)=CC=1
Isoxazolidine,3-(1H-imidazol-1-ylmethyl)-2-methyl-3,5-diphenyl-, cis- (9CI) InChi 编码:
InChI=1S/C20H21N3O/c1-22-20(15-23-13-12-21-16-23,18-10-6-3-7-11-18)14-19(24-22)17-8-4-2-5-9-17/h2-13,16,19H,14-15H2,1H3/t19-,20+/m0/s1
Isoxazolidine,3-(1H-imidazol-1-ylmethyl)-2-methyl-3,5-diphenyl-, cis- (9CI) InChiKey 编码:
ZLCZSNKZIIEUBS-VQTJNVASSA-N