| SpectraBase Spectrum ID |
EiZcHjnEYPS |
| Name |
(E)-N-[3-Benzoyl-4-[[2-(4-methylphenyl)-1-oxoethyl]amino]phenyl]-3-(2-nitrophenyl)-2-propenamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
519.179420912 u |
| Formula |
C31H25N3O5 |
| InChI |
InChI=1S/C31H25N3O5/c1-21-11-13-22(14-12-21)19-30(36)33-27-17-16-25(20-26(27)31(37)24-8-3-2-4-9-24)32-29(35)18-15-23-7-5-6-10-28(23)34(38)39/h2-18,20H,19H2,1H3,(H,32,35)(H,33,36)/b18-15+ |
| InChIKey |
JUKGWOVXHZKEBM-OBGWFSINSA-N |
| Molecular Weight |
519.557 g/mol |
| SMILES |
C=1C=C(NC(\C=C\C2=CC=CC=C2[N+](=O)[O-])=O)C=C(C(=O)C2=CC=CC=C2)C1NC(CC1=CC=C(C=C1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818622 |
![(E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)-1-oxoethyl]amino]phenyl]-3-(2-nitrophenyl)-2-propenamide](/api/spectrum/EiZcHjnEYPS/structure.png?h=300&w=458 "(E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)-1-oxoethyl]amino]phenyl]-3-(2-nitrophenyl)-2-propenamide")
