SpectraBase Spectrum ID |
Atn7IH0j6N7 |
Name |
Methyl (2E)-3-(4-Chlorophenyl)-2-[(toluene-4-sulfonylamino)methyl]acrylate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H18ClNO4S |
InChI |
InChI=1S/C18H18ClNO4S/c1-13-3-9-17(10-4-13)25(22,23)20-12-15(18(21)24-2)11-14-5-7-16(19)8-6-14/h3-11,20H,12H2,1-2H3/b15-11+ |
InChIKey |
PTZFRIVYHQRAAX-RVDMUPIBSA-N |
Molecular Weight |
379.858 g/mol |
SMILES |
N(C\C(C(=O)OC)=C/c1ccc(cc1)Cl)S(=O)(=O)c1ccc(cc1)C |
SPLASH |
splash10-00di-0090000000-f5cddc2b280fa437d454 |
Source of Spectrum |
F-69-424-12 |
Synonyms |
methyl (2E)-3-(4-chlorophenyl)-2-({[(4-methylphenyl)sulfonyl]amino}methyl)-2-propenoate |
Wiley ID |
1594482 |