| SpectraBase Spectrum ID |
63cwQyu8Ee0 |
| Name |
N-Benzyl-N-(4-(2-chlorophenyl)-2-oxo-2,5-dihydro-1H-benzo[B][1,4]diazepin-3-yl)acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.124404594 u |
| Formula |
C24H20ClN3O2 |
| InChI |
InChI=1S/C24H20ClN3O2/c1-16(29)28(15-17-9-3-2-4-10-17)23-22(18-11-5-6-12-19(18)25)26-20-13-7-8-14-21(20)27-24(23)30/h2-14,26H,15H2,1H3,(H,27,30) |
| InChIKey |
FBRLTDGRMNTKCR-UHFFFAOYSA-N |
| Molecular Weight |
417.896 g/mol |
| SMILES |
C(C)(=O)N(C1=C(NC2=C(NC1=O)C=CC=C2)C1=C(C=CC=C1)Cl)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91743 |
![N-Benzyl-N-(4-(2-chlorophenyl)-2-oxo-2,5-dihydro-1H-benzo[B][1,4]diazepin-3-yl)acetamide](/api/spectrum/63cwQyu8Ee0/structure.png?h=300&w=458 "N-Benzyl-N-(4-(2-chlorophenyl)-2-oxo-2,5-dihydro-1H-benzo[B][1,4]diazepin-3-yl)acetamide")
