SpectraBase Spectrum ID |
BMkwAjqDLGH |
Name |
Benzoic acid, 3-bromo-, 4-[(E)-[2-[2-(4-chlorophenoxy)acetyl]hydrazono]methyl]phenyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
485.998197699 u |
Formula |
C22H16BrClN2O4 |
InChI |
InChI=1S/C22H16BrClN2O4/c23-17-3-1-2-16(12-17)22(28)30-20-8-4-15(5-9-20)13-25-26-21(27)14-29-19-10-6-18(24)7-11-19/h1-13H,14H2,(H,26,27)/b25-13+ |
InChIKey |
HZXVXACWCFNNRD-DHRITJCHSA-N |
Molecular Weight |
487.737 g/mol |
SMILES |
N(C(=O)COC=1C=CC(=CC1)Cl)\N=C\C1=CC=C(OC(C=2C=C(Br)C=CC2)=O)C=C1 |