SpectraBase Spectrum ID |
JslYBBXsBXx |
Name |
2H-Pyrrolo[3,4-D]isoxazole-4,6(3H,5H)-dione, 5-(4-ethoxyphenyl)dihydro-2-phenyl-3-(2-thienyl)- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
420.114378302 u |
Formula |
C23H20N2O4S |
InChI |
InChI=1S/C23H20N2O4S/c1-2-28-17-12-10-15(11-13-17)24-22(26)19-20(18-9-6-14-30-18)25(29-21(19)23(24)27)16-7-4-3-5-8-16/h3-14,19-21H,2H2,1H3 |
InChIKey |
ZPZGLGQNLNPWBX-UHFFFAOYSA-N |
Molecular Weight |
420.483 g/mol |
SMILES |
C12C(C(=O)N(C2=O)C=2C=CC(=CC2)OCC)ON(C1C=1SC=CC1)C1=CC=CC=C1 |