| SpectraBase Spectrum ID |
JVETzdQ69Yj |
| Name |
7-Chloro-2,3-dihydro-5-phenyl-3-[(pyrrolyl-2)methylene]-1H-1,4-benzodiazepin-2-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.082539782 u |
| Formula |
C20H14ClN3O |
| InChI |
InChI=1S/C20H14ClN3O/c21-14-8-9-17-16(11-14)19(13-5-2-1-3-6-13)23-18(20(25)24-17)12-15-7-4-10-22-15/h1-12,22H,(H,24,25)/b18-12+ |
| InChIKey |
QXGDKXYOULVCKD-LDADJPATSA-N |
| Molecular Weight |
347.805 g/mol |
| SMILES |
C12=C(C=CC(=C2)Cl)NC(\C(N=C1C1=CC=CC=C1)=C/C1=CC=CN1)=O |
![7-Chloro-2,3-dihydro-5-phenyl-3-[(pyrrolyl-2)methylene]-1H-1,4-benzodiazepin-2-one](/api/spectrum/JVETzdQ69Yj/structure.png?h=300&w=458 "7-Chloro-2,3-dihydro-5-phenyl-3-[(pyrrolyl-2)methylene]-1H-1,4-benzodiazepin-2-one")
