| SpectraBase Spectrum ID |
CQCdZXpuIlc |
| Name |
(E)-2-[(4-Nitrophenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester |
| Alternate Name(s) |
phenyl (2E)-2-[{[(4-methylphenyl)sulfonyl]amino}(4-nitrophenyl)methyl]-2,4-pentadienoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22N2O6S |
| InChI |
InChI=1S/C25H22N2O6S/c1-3-7-23(25(28)33-21-8-5-4-6-9-21)24(19-12-14-20(15-13-19)27(29)30)26-34(31,32)22-16-10-18(2)11-17-22/h3-17,24,26H,1H2,2H3/b23-7+ |
| InChIKey |
CABIQNATIBTLNN-HCGXMYGOSA-N |
| Molecular Weight |
478.519 g/mol |
| SMILES |
N(S(c1ccc(cc1)C)(=O)=O)C(\C(C(Oc1ccccc1)=O)=C/C=C)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-0006-9000000000-f6af884f77d6120eb7f5 |
| Source of Spectrum |
F-62-473-8 |
| Wiley ID |
1631848 |
![(E)-2-[(4-Nitrophenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester](/api/spectrum/CQCdZXpuIlc/structure.png?h=300&w=458 "(E)-2-[(4-Nitrophenyl)(toluene-4-sulfonylamino)methyl]penta-2,4-dienoic acid phenyl ester")
