SpectraBase Spectrum ID |
I6paFHIv01l |
Name |
3,5-Pyridinedicarboxylic acid, 4-[3-[(2-furanylcarbonyl)amino]phenyl]-2,6-dimethyl-, dimethyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
408.132136366 u |
Formula |
C22H20N2O6 |
InChI |
InChI=1S/C22H20N2O6/c1-12-17(21(26)28-3)19(18(13(2)23-12)22(27)29-4)14-7-5-8-15(11-14)24-20(25)16-9-6-10-30-16/h5-11H,1-4H3,(H,24,25) |
InChIKey |
IUGNGUSVDCONTB-UHFFFAOYSA-N |
Molecular Weight |
408.410 g/mol |
SMILES |
C=1(C(C(OC)=O)=C(C(=C(N1)C)C(=O)OC)C1=CC(=CC=C1)NC(C=1OC=CC1)=O)C |