| SpectraBase Spectrum ID |
B4SF9xyChEm |
| Name |
Butanoic acid, 4-[[2-[6-(1,3-dithiolan-2-yl)-1,3-benzodioxol-5-yl]ethyl]amino]-4-oxo-, methyl ester |
| CAS Registry Number |
124021-70-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21NO5S2 |
| InChI |
InChI=1S/C17H21NO5S2/c1-21-16(20)3-2-15(19)18-5-4-11-8-13-14(23-10-22-13)9-12(11)17-24-6-7-25-17/h8-9,17H,2-7,10H2,1H3,(H,18,19) |
| InChIKey |
CVROHRJCSBUZKW-UHFFFAOYSA-N |
| Molecular Weight |
383.477 g/mol |
| SMILES |
N(C(=O)CCC(=O)OC)CCc1c(cc2OCOc2c1)C1SCCS1 |
| SPLASH |
splash10-004i-0692000000-a81d71ce2a4b44be2eaa |
| Source of Spectrum |
J-55-834-8 |
| Synonyms |
Methyl 4-({2-[6-(1,3-dithiolan-2-yl)-1,3-benzodioxol-5-yl]ethyl}amino)-4-oxobutanoate |
| Wiley ID |
1360992 |
![Butanoic acid, 4-[[2-[6-(1,3-dithiolan-2-yl)-1,3-benzodioxol-5-yl]ethyl]amino]-4-oxo-, methyl ester](/api/spectrum/B4SF9xyChEm/structure.png?h=300&w=458 "Butanoic acid, 4-[[2-[6-(1,3-dithiolan-2-yl)-1,3-benzodioxol-5-yl]ethyl]amino]-4-oxo-, methyl ester")
