| SpectraBase Spectrum ID |
BKWZndwG7cj |
| Name |
Acetic acid, ester with 7-chloro-1,3-dihydro-5-(o-fluorophenyl)-3-hydroxy-2H-1,4-benzodiazepin-2-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.052048114 u |
| Formula |
C17H12ClFN2O3 |
| InChI |
InChI=1S/C17H12ClFN2O3/c1-9(22)24-17-16(23)20-14-7-6-10(18)8-12(14)15(21-17)11-4-2-3-5-13(11)19/h2-8,17H,1H3,(H,20,23) |
| InChIKey |
ZQGZUOLMBIKREL-UHFFFAOYSA-N |
| Molecular Weight |
346.745 g/mol |
| SMILES |
CC(OC1C(=O)NC=2C=CC(Cl)=CC2C(C=2C=CC=CC2F)=N1)=O |
