SpectraBase Spectrum ID |
45nSjgMnlMF |
Name |
[3-(3-chloroquioxalin-2-yl)-4-iodo-1-phenyl-1H-pyrazol-5-yl]methyl acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H14ClIN4O2 |
InChI |
InChI=1S/C20H14ClIN4O2/c1-12(27)28-11-16-17(22)18(25-26(16)13-7-3-2-4-8-13)19-20(21)24-15-10-6-5-9-14(15)23-19/h2-10H,11H2,1H3 |
InChIKey |
HSIVMJOHLKNCAN-UHFFFAOYSA-N |
Molecular Weight |
504.715 g/mol |
SMILES |
c1(n[n](-c2ccccc2)c(c1I)COC(=O)C)-c1nc2ccccc2nc1Cl |
SPLASH |
splash10-0k9i-0007090000-3fbd11823fae1376ffc2 |
Source of Spectrum |
Y-48-1221-9b |
Wiley ID |
1704564 |