| SpectraBase Spectrum ID |
6rBrE5i9bTC |
| Name |
Benzoic acid, 4-[[(2E)-3-(3,4-dimethoxyphenyl)-1-oxo-2-propenyl]amino]-, 2-ethoxyethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
399.168187523 u |
| Formula |
C22H25NO6 |
| InChI |
InChI=1S/C22H25NO6/c1-4-28-13-14-29-22(25)17-7-9-18(10-8-17)23-21(24)12-6-16-5-11-19(26-2)20(15-16)27-3/h5-12,15H,4,13-14H2,1-3H3,(H,23,24)/b12-6+ |
| InChIKey |
NKWUJQMJWBNMJV-WUXMJOGZSA-N |
| Molecular Weight |
399.443 g/mol |
| SMILES |
N(C(\C=C\C=1C=C(OC)C(=CC1)OC)=O)C1=CC=C(C(=O)OCCOCC)C=C1 |