| SpectraBase Spectrum ID |
2BXOB0q3Nj6 |
| Name |
Ethyl-3-benzyl-7-exo-N,N-diethylamino-2-exo-o-nitrophenyl-3-azabicyclo[3.2.0]heptane-6-endo-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H33N3O4 |
| InChI |
InChI=1S/C26H33N3O4/c1-4-27(5-2)25-22-20(23(25)26(30)33-6-3)17-28(16-18-12-8-7-9-13-18)24(22)19-14-10-11-15-21(19)29(31)32/h7-15,20,22-25H,4-6,16-17H2,1-3H3/t20-,22-,23-,24-,25-/m1/s1 |
| InChIKey |
PNZMLLPZLXVXNB-KUEHFBCJSA-N |
| Molecular Weight |
451.567 g/mol |
| SMILES |
[C@@]1(c2ccccc2[N+](=O)[O-])(N(C[C@]2([H])[C@@]1([H])[C@@](N(CC)CC)([C@@]2(C(=O)OCC)[H])[H])Cc1ccccc1)[H] |
| SPLASH |
splash10-0006-9300000000-7e89fd2a1d641f7bf406 |
| Source of Spectrum |
A1-12-2230/SMS4-4h |
| Synonyms |
(1S,2S,5R,6R,7R)-ethyl 3-benzyl-7-(diethylamino)-2-(2-nitrophenyl)-3-azabicyclo[3.2.0]heptane-6-carboxylate |
| Wiley ID |
1752173 |
![Ethyl-3-benzyl-7-exo-N,N-diethylamino-2-exo-o-nitrophenyl-3-azabicyclo[3.2.0]heptane-6-endo-carboxylate](/api/spectrum/2BXOB0q3Nj6/structure.png?h=300&w=458 "Ethyl-3-benzyl-7-exo-N,N-diethylamino-2-exo-o-nitrophenyl-3-azabicyclo[3.2.0]heptane-6-endo-carboxylate")
