| SpectraBase Spectrum ID |
21WbjfI46f8 |
| Name |
2-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]-2-propenoyl}amino)benzoic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.158291545 u |
| Formula |
C21H21N3O3 |
| InChI |
InChI=1S/C21H21N3O3/c1-3-24(4-2)17-11-9-15(10-12-17)13-16(14-22)20(25)23-19-8-6-5-7-18(19)21(26)27/h5-13H,3-4H2,1-2H3,(H,23,25)(H,26,27)/b16-13+ |
| InChIKey |
SPUWWNADMNGQSJ-DTQAZKPQSA-N |
| Molecular Weight |
363.417 g/mol |
| SMILES |
N(C(=O)\C(C#N)=C\C1=CC=C(C=C1)N(CC)CC)C1=C(C(O)=O)C=CC=C1 |
![2-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]-2-propenoyl}amino)benzoic acid](/api/spectrum/21WbjfI46f8/structure.png?h=300&w=458 "2-({(2E)-2-cyano-3-[4-(diethylamino)phenyl]-2-propenoyl}amino)benzoic acid")
