SpectraBase Spectrum ID |
KmL5yR8Bqry |
Name |
2-Benzyl-1-[3-(dimethylcarbamoyl)propyl]-5-nitro-1,2-dihydro-3H-indazol-3-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
382.164105200 u |
Formula |
C20H22N4O4 |
InChI |
InChI=1S/C20H22N4O4/c1-21(2)19(25)9-6-12-22-18-11-10-16(24(27)28)13-17(18)20(26)23(22)14-15-7-4-3-5-8-15/h3-5,7-8,10-11,13H,6,9,12,14H2,1-2H3 |
InChIKey |
LZKDAFYSBJOUOG-UHFFFAOYSA-N |
Ionization Type |
EI |
Molecular Weight |
382.420 g/mol |
Quality |
144 |
SMILES |
C1(=CC=CC=C1)CN1N(C2=C(C1=O)C=C(C=C2)[N+](=O)[O-])CCCC(=O)N(C)C |
SPLASH |
splash10-03yj-0973000000-365ba2230ccef368a17a |
Source of Spectrum |
ES2614131A1 |
Wiley ID |
1894582 |