SpectraBase Spectrum ID |
60IlKTALqui |
Name |
1H-indene-1-acetic acid, 6-fluoro-2,3-dihydro-2-methyl-3-[[4-(methylsulfinyl)phenyl]methylene]-, methyl ester, |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H21FO3S |
InChI |
InChI=1S/C21H21FO3S/c1-13-18(10-14-4-7-16(8-5-14)26(3)24)17-9-6-15(22)11-20(17)19(13)12-21(23)25-2/h4-11,13,19H,12H2,1-3H3/b18-10- |
InChIKey |
MWSVZXXBJBXXSJ-ZDLGFXPLSA-N |
Molecular Weight |
372.454 g/mol |
SMILES |
c1c(cc2C(C(\C(=C\c3ccc(cc3)S(C)=O)c2c1)C)CC(=O)OC)F |
SPLASH |
splash10-001j-0193000000-294785faef998e632f52 |
Synonyms |
Methyl {(3Z)-6-fluoro-2-methyl-3-[4-(methylsulfinyl)benzylidene]-2,3-dihydro-1H-inden-1-yl}acetate
Sulindac methyl ester artifact 1-nominalmass 370 |
Wiley ID |
1507800 |