| SpectraBase Spectrum ID |
FIBpYK2zPXi |
| Name |
1,3-Dithiane-2-carboxylic acid, 2-[6-[2-[(4-methoxy-1,4-dioxobutyl)amino]ethyl]-1,3-benzodioxol-5-yl]-, methyl ester |
| CAS Registry Number |
124021-80-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H25NO7S2 |
| InChI |
InChI=1S/C20H25NO7S2/c1-25-18(23)5-4-17(22)21-7-6-13-10-15-16(28-12-27-15)11-14(13)20(19(24)26-2)29-8-3-9-30-20/h10-11H,3-9,12H2,1-2H3,(H,21,22) |
| InChIKey |
KPLCROXEKQTZRB-UHFFFAOYSA-N |
| Molecular Weight |
455.540 g/mol |
| SMILES |
N(C(=O)CCC(=O)OC)CCc1c(C2(C(=O)OC)SCCCS2)cc2OCOc2c1 |
| SPLASH |
splash10-014j-0190000000-21f97ef69e8df0ce26f7 |
| Source of Spectrum |
J-55-835-21 |
| Synonyms |
Methyl 2-(6-{2-[(4-methoxy-4-oxobutanoyl)amino]ethyl}-1,3-benzodioxol-5-yl)-1,3-dithiane-2-carboxylate |
| Wiley ID |
1388984 |
![1,3-Dithiane-2-carboxylic acid, 2-[6-[2-[(4-methoxy-1,4-dioxobutyl)amino]ethyl]-1,3-benzodioxol-5-yl]-, methyl ester](/api/spectrum/FIBpYK2zPXi/structure.png?h=300&w=458 "1,3-Dithiane-2-carboxylic acid, 2-[6-[2-[(4-methoxy-1,4-dioxobutyl)amino]ethyl]-1,3-benzodioxol-5-yl]-, methyl ester")
