| SpectraBase Spectrum ID |
EzQ8qDMnAhn |
| Name |
2-[(3S,4S)-3-Isopropenyl-1-(toluene-4-sulfonyl)-piperidin-4-yl]-malonic acid diethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H31NO6S |
| InChI |
InChI=1S/C22H31NO6S/c1-6-28-21(24)20(22(25)29-7-2)18-12-13-23(14-19(18)15(3)4)30(26,27)17-10-8-16(5)9-11-17/h8-11,18-20H,3,6-7,12-14H2,1-2,4-5H3/t18-,19+/m0/s1 |
| InChIKey |
UCPWKDJWJDWWKZ-RBUKOAKNSA-N |
| Molecular Weight |
437.551 g/mol |
| SMILES |
C1N(S(c2ccc(cc2)C)(=O)=O)CC[C@@]([C@]1(C(=C)C)[H])(C(C(=O)OCC)C(=O)OCC)[H] |
| SPLASH |
splash10-000x-9460000000-b9a5258d2bf2f7428e19 |
| Source of Spectrum |
Y1-46-6614-21 |
| Synonyms |
(3R*,4S*)-4-[Bis(carboethoxy)methyl]-3-isopropenyl-1-(toluene-4-sulfonyl)piperidine
Diethyl 2-{(3S,4S)-3-isopropenyl-1-[(4-methylphenyl)sulfonyl]piperidinyl}malonate |
| Wiley ID |
1622629 |
![2-[(3S,4S)-3-Isopropenyl-1-(toluene-4-sulfonyl)-piperidin-4-yl]-malonic acid diethyl ester](/api/spectrum/EzQ8qDMnAhn/structure.png?h=300&w=458 "2-[(3S,4S)-3-Isopropenyl-1-(toluene-4-sulfonyl)-piperidin-4-yl]-malonic acid diethyl ester")
