SpectraBase Spectrum ID |
Imv2XD3KBes |
Name |
Benzoic acid, 7-(4-nitrophenyl)-2-thioxo-2H-benzoxathiol-5-yl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H11NO5S2 |
InChI |
InChI=1S/C20H11NO5S2/c22-19(13-4-2-1-3-5-13)25-15-10-16(18-17(11-15)28-20(27)26-18)12-6-8-14(9-7-12)21(23)24/h1-11H |
InChIKey |
MEZFLDYLHXALMF-UHFFFAOYSA-N |
Molecular Weight |
409.430 g/mol |
SMILES |
c12c(SC(O2)=S)cc(cc1-c1ccc(N(=O)=O)cc1)OC(=O)c1ccccc1 |
SPLASH |
splash10-0a4i-6900000000-0c04fc4fe26a198a8d43 |
Source of Spectrum |
AD-0-2532-0 |
Synonyms |
benzoic acid [7-(4-nitrophenyl)-2-sulfanylidene-1,3-benzoxathiol-5-yl] ester
[7-(4-nitrophenyl)-2-thioxo-1,3-benzoxathiol-5-yl] benzoate
[7-(4-nitrophenyl)-2-sulfanylidene-1,3-benzoxathiol-5-yl] benzoate |
Wiley ID |
1430561 |