| SpectraBase Spectrum ID |
Db6OXyW6RLn |
| Name |
(2S,3R)-2-(1-Besylindol-2-yl)-3-ethyl-4-piperidone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.135113747 u |
| Formula |
C21H22N2O3S |
| InChI |
InChI=1S/C21H22N2O3S/c1-2-17-20(24)12-13-22-21(17)19-14-15-8-6-7-11-18(15)23(19)27(25,26)16-9-4-3-5-10-16/h3-11,14,17,21-22H,2,12-13H2,1H3/t17-,21-/m0/s1 |
| InChIKey |
SOUYOBCMWZNLKC-UWJYYQICSA-N |
| Molecular Weight |
382.478 g/mol |
| SMILES |
C=1(S(N2C(=CC3=C2C=CC=C3)[C@@]2([C@](C(=O)CCN2)(CC)[H])[H])(=O)=O)C=CC=CC1 |
