| SpectraBase Spectrum ID |
2g5tDyKPceX |
| Name |
Benzoic acid, 3-[(5-chloro-2-methoxybenzoyl)amino]-, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
333.076785695 u |
| Formula |
C17H16ClNO4 |
| InChI |
InChI=1S/C17H16ClNO4/c1-3-23-17(21)11-5-4-6-13(9-11)19-16(20)14-10-12(18)7-8-15(14)22-2/h4-10H,3H2,1-2H3,(H,19,20) |
| InChIKey |
LGGLXUDQGOSXON-UHFFFAOYSA-N |
| Molecular Weight |
333.771 g/mol |
| SMILES |
C1(C(NC2=CC=CC(C(=O)OCC)=C2)=O)=C(C=CC(=C1)Cl)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956081 |
![Benzoic acid, 3-[(5-chloro-2-methoxybenzoyl)amino]-, ethyl ester](/api/spectrum/2g5tDyKPceX/structure.png?h=300&w=458 "Benzoic acid, 3-[(5-chloro-2-methoxybenzoyl)amino]-, ethyl ester")
