| SpectraBase Spectrum ID |
LBiu2KcUz30 |
| Name |
Benzoic acid, 4-[[3-oxo-1,2-benzisothiazol-2(3H)-yl]methyl]-, methyl ester, S,S-dioxide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H13NO5S |
| InChI |
InChI=1S/C16H13NO5S/c1-22-16(19)12-8-6-11(7-9-12)10-17-15(18)13-4-2-3-5-14(13)23(17,20)21/h2-9H,10H2,1H3 |
| InChIKey |
OHEACIPGVRWTCE-UHFFFAOYSA-N |
| Molecular Weight |
331.342 g/mol |
| SMILES |
c1ccc2c(S(N(C2=O)Cc2ccc(C(=O)OC)cc2)(=O)=O)c1 |
| SPLASH |
splash10-014i-3591000000-c0917063fdeb2b140573 |
| Synonyms |
4-[(1,1,3-triketo-1,2-benzothiazol-2-yl)methyl]benzoic acid methyl ester
4-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzoic acid methyl ester
Methyl 4-[(1,1,3-trioxo-1,2-benzothiazol-2-yl)methyl]benzoate
Methyl 4-[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)methyl]benzoate
Methyl 4-[[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]methyl]benzoate |
| Wiley ID |
1450112 |
![Benzoic acid, 4-[[3-oxo-1,2-benzisothiazol-2(3H)-yl]methyl]-, methyl ester, S,S-dioxide](/api/spectrum/LBiu2KcUz30/structure.png?h=300&w=458 "Benzoic acid, 4-[[3-oxo-1,2-benzisothiazol-2(3H)-yl]methyl]-, methyl ester, S,S-dioxide")
