SpectraBase Spectrum ID |
6n3VwnGbZ45 |
Name |
Methyl 5-[(2-chlorobenzoyl)oxy]-1-phenyl-1H-pyrazole-3-carboxylate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
356.056384603 u |
Formula |
C18H13ClN2O4 |
InChI |
InChI=1S/C18H13ClN2O4/c1-24-18(23)15-11-16(21(20-15)12-7-3-2-4-8-12)25-17(22)13-9-5-6-10-14(13)19/h2-11H,1H3 |
InChIKey |
UCFOCRVPGYTJCU-UHFFFAOYSA-N |
Molecular Weight |
356.765 g/mol |
SMILES |
C=1(N(N=C(C1)C(=O)OC)C1=CC=CC=C1)OC(C=1C(Cl)=CC=CC1)=O |