SpectraBase Spectrum ID |
KXjTKz5kjPm |
Name |
N,N-bis[2-[3,5-bis(Ethoxycarbonyl)phenoxy]ethyl]-p-toluene sulfonamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
699.234946926 u |
Formula |
C35H41NO12S |
InChI |
InChI=1S/C35H41NO12S/c1-6-43-32(37)25-18-26(33(38)44-7-2)21-29(20-25)47-16-14-36(49(41,42)31-12-10-24(5)11-13-31)15-17-48-30-22-27(34(39)45-8-3)19-28(23-30)35(40)46-9-4/h10-13,18-23H,6-9,14-17H2,1-5H3 |
InChIKey |
GDVOJYFXJOKECY-UHFFFAOYSA-N |
Molecular Weight |
699.768 g/mol |
SMILES |
C(N(S(C=1C=CC(=CC1)C)(=O)=O)CCOC=1C=C(C(=O)OCC)C=C(C1)C(=O)OCC)COC=1C=C(C(=O)OCC)C=C(C1)C(=O)OCC |