SpectraBase Spectrum ID |
JNyOtjxRU39 |
Name |
Benzyl 5-(1-methyl-1H-imidazol-2-yl)-4-(4-nitrophenyl)-5-oxopentanoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H21N3O5 |
InChI |
InChI=1S/C22H21N3O5/c1-24-14-13-23-22(24)21(27)19(17-7-9-18(10-8-17)25(28)29)11-12-20(26)30-15-16-5-3-2-4-6-16/h2-10,13-14,19H,11-12,15H2,1H3 |
InChIKey |
YBAHKIMMZJLNSF-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002/adsc.201600278 |
Molecular Weight |
407.426 g/mol |
SMILES |
C(CCC(C(=O)c1ncc[n]1C)c1ccc(cc1)[N+](=O)[O-])(=O)OCc1ccccc1 |
SPLASH |
splash10-0a4l-3490100000-f22fd9a0842746688f11 |
Source of Spectrum |
ASC-358-2474-13 |
Wiley ID |
1798682 |