| SpectraBase Spectrum ID |
F5JjQpnYn74 |
| Name |
Benzoic acid, 4-[(E)-[[2-[(4-butylphenyl)amino]-1,2-dioxoethyl]hydrazono]methyl]-, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
381.168856229 u |
| Formula |
C21H23N3O4 |
| InChI |
InChI=1S/C21H23N3O4/c1-3-4-5-15-8-12-18(13-9-15)23-19(25)20(26)24-22-14-16-6-10-17(11-7-16)21(27)28-2/h6-14H,3-5H2,1-2H3,(H,23,25)(H,24,26)/b22-14+ |
| InChIKey |
KKXJHSFPAKZCST-HYARGMPZSA-N |
| Molecular Weight |
381.432 g/mol |
| SMILES |
N(C(C(N\N=C\C=1C=CC(C(=O)OC)=CC1)=O)=O)C1=CC=C(C=C1)CCCC |
![benzoic acid, 4-[(E)-[[2-[(4-butylphenyl)amino]-1,2-dioxoethyl]hydrazono]methyl]-, methyl ester](/api/spectrum/F5JjQpnYn74/structure.png?h=300&w=458 "benzoic acid, 4-[(E)-[[2-[(4-butylphenyl)amino]-1,2-dioxoethyl]hydrazono]methyl]-, methyl ester")
