| SpectraBase Spectrum ID |
BRJulqXf0D7 |
| Name |
4-[2-Nitro-4-(trifluoromethyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
462.112659366 u |
| Formula |
C19H16F6N4O3 |
| InChI |
InChI=1S/C19H16F6N4O3/c20-18(21,22)12-2-1-3-14(10-12)26-17(30)28-8-6-27(7-9-28)15-5-4-13(19(23,24)25)11-16(15)29(31)32/h1-5,10-11H,6-9H2,(H,26,30) |
| InChIKey |
VSTDZLWVOCFKPA-UHFFFAOYSA-N |
| Molecular Weight |
462.352 g/mol |
| SMILES |
C=1(N(=O)=O)C(N2CCN(C(NC3=CC(C(F)(F)F)=CC=C3)=O)CC2)=CC=C(C(F)(F)F)C1 |
![4-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide](/api/spectrum/BRJulqXf0D7/structure.png?h=300&w=458 "4-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide")
