SpectraBase Spectrum ID |
LQMsTs50l9P |
Name |
Benzenepropanoic acid, .beta.-[[[4-(acetylamino)phenyl]sulfonyl]amino]-4-chloro- |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H17ClN2O5S |
InChI |
InChI=1S/C17H17ClN2O5S/c1-11(21)19-14-6-8-15(9-7-14)26(24,25)20-16(10-17(22)23)12-2-4-13(18)5-3-12/h2-9,16,20H,10H2,1H3,(H,19,21)(H,22,23) |
InChIKey |
UVQIPZNXTNPIJW-UHFFFAOYSA-N |
Molecular Weight |
396.845 g/mol |
SMILES |
OC(CC(c1ccc(cc1)Cl)NS(c1ccc(cc1)NC(C)=O)(=O)=O)=O |
SPLASH |
splash10-0006-9500000000-2621c02729bf2328e944 |
Source of Spectrum |
IY-1-4652-3 |
Synonyms |
3-[(4-acetamidophenyl)sulfonylamino]-3-(4-chlorophenyl)propanoic acid |
Wiley ID |
1654506 |