| SpectraBase Spectrum ID |
1Rk9NYYDy5M |
| Name |
7-Bromo-3-(4-bromo-benzylidene)-5-(2-chloro-phenyl)-1,3-dihydro-benzo[E][1,4]diazepin-2-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
513.908316746 u |
| Formula |
C22H13Br2ClN2O |
| InChI |
InChI=1S/C22H13Br2ClN2O/c23-14-7-5-13(6-8-14)11-20-22(28)27-19-10-9-15(24)12-17(19)21(26-20)16-3-1-2-4-18(16)25/h1-12H,(H,27,28)/b20-11+ |
| InChIKey |
VKUCUFXYFDYKMS-RGVLZGJSSA-N |
| Molecular Weight |
516.620 g/mol |
| SMILES |
C1(=N\C(C(=O)NC2=C1C=C(Br)C=C2)=C/C1=CC=C(C=C1)Br)C1=C(Cl)C=CC=C1 |
![7-Bromo-3-(4-bromo-benzylidene)-5-(2-chloro-phenyl)-1,3-dihydro-benzo[E][1,4]diazepin-2-one](/api/spectrum/1Rk9NYYDy5M/structure.png?h=300&w=458 "7-Bromo-3-(4-bromo-benzylidene)-5-(2-chloro-phenyl)-1,3-dihydro-benzo[E][1,4]diazepin-2-one")
