| SpectraBase Spectrum ID |
FRopDKeFSHj |
| Name |
(S)-3-(1,1-Difluoro-2-oxo-2-phenyl-ethyl)-1,1-dioxo-2,3-dihydro-1H-1lambda(6)-benzo[d]isothiazole-3-carboxylic acid methyl ester |
| Alternate Name(s) |
Methyl (S)-3-(1,1-difluoro-2-oxo-2-phenylethyl)-2,3-dihydrobenzo[d]isothiazole-3-carboxylate 1,1-dioxide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H13F2NO5S |
| InChI |
InChI=1S/C17H13F2NO5S/c1-25-15(22)16(12-9-5-6-10-13(12)26(23,24)20-16)17(18,19)14(21)11-7-3-2-4-8-11/h2-10,20H,1H3/t16-/m0/s1 |
| InChIKey |
QCVVDMGGYGGKTA-INIZCTEOSA-N |
| Literature Reference DOI |
10.1039/C5QO00407A |
| Molecular Weight |
381.350 g/mol |
| SMILES |
N1S(c2ccccc2[C@@]1(C(C(c1ccccc1)=O)(F)F)C(OC)=O)(=O)=O |
| SPLASH |
splash10-0a6r-3921000000-af226695adb6edc1f1cf |
| Source of Spectrum |
OCF-3-298/SM4-3b |
| Wiley ID |
1804790 |
![(S)-3-(1,1-Difluoro-2-oxo-2-phenyl-ethyl)-1,1-dioxo-2,3-dihydro-1H-1lambda(6)-benzo[d]isothiazole-3-carboxylic acid methyl ester](/api/spectrum/FRopDKeFSHj/structure.png?h=300&w=458 "(S)-3-(1,1-Difluoro-2-oxo-2-phenyl-ethyl)-1,1-dioxo-2,3-dihydro-1H-1lambda(6)-benzo[d]isothiazole-3-carboxylic acid methyl ester")
