| SpectraBase Spectrum ID |
HMokydUWH55 |
| Name |
{4-Bromo-2-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.021519967 u |
| Formula |
C19H15BrN2O4 |
| InChI |
InChI=1S/C19H15BrN2O4/c1-12-16(19(25)22(21-12)15-5-3-2-4-6-15)10-13-9-14(20)7-8-17(13)26-11-18(23)24/h2-10H,11H2,1H3,(H,23,24)/b16-10+ |
| InChIKey |
DQYUYMBPUDGCMC-MHWRWJLKSA-N |
| Molecular Weight |
415.243 g/mol |
| SMILES |
OC(COC1=C(\C=C\2C(N(C3=CC=CC=C3)N=C2C)=O)C=C(C=C1)Br)=O |
![{4-bromo-2-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetic acid](/api/spectrum/HMokydUWH55/structure.png?h=300&w=458 "{4-bromo-2-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenoxy}acetic acid")
