| SpectraBase Spectrum ID |
95nmX6AiVj |
| Name |
1,2-Benzenedicarboxylic acid, 4-[ethyl[(1-hydroxy-2-naphthalenyl)carbonyl]amino]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
379.105587265 u |
| Formula |
C21H17NO6 |
| InChI |
InChI=1S/C21H17NO6/c1-2-22(13-8-10-15(20(25)26)17(11-13)21(27)28)19(24)16-9-7-12-5-3-4-6-14(12)18(16)23/h3-11,23H,2H2,1H3,(H,25,26)(H,27,28) |
| InChIKey |
KWOXQCHAVMHHNY-UHFFFAOYSA-N |
| Molecular Weight |
379.368 g/mol |
| SMILES |
CCN(C(=O)C1=CC=C2C(=C1O)C=CC=C2)C1=CC=C(C(=C1)C(O)=O)C(O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936786 |
![1,2-Benzenedicarboxylic acid, 4-[ethyl[(1-hydroxy-2-naphthalenyl)carbonyl]amino]-](/api/spectrum/95nmX6AiVj/structure.png?h=300&w=458 "1,2-Benzenedicarboxylic acid, 4-[ethyl[(1-hydroxy-2-naphthalenyl)carbonyl]amino]-")
