| SpectraBase Spectrum ID |
6ySSg6lPt0b |
| Name |
1-[4-(2-Chlorobenzyl)oxyphenyl]-5-keto-N-sec-butyl-pyrrolidine-3-carboxamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
400.155370370 u |
| Formula |
C22H25ClN2O3 |
| InChI |
InChI=1S/C22H25ClN2O3/c1-3-15(2)24-22(27)17-12-21(26)25(13-17)18-8-10-19(11-9-18)28-14-16-6-4-5-7-20(16)23/h4-11,15,17H,3,12-14H2,1-2H3,(H,24,27) |
| InChIKey |
OIFDEWWHGJUKHC-UHFFFAOYSA-N |
| Molecular Weight |
400.906 g/mol |
| SMILES |
C=1C=CC(COC=2C=CC(N3C(CC(C3)C(NC(CC)C)=O)=O)=CC2)=C(Cl)C1 |
![1-[4-(2-chlorobenzyl)oxyphenyl]-5-keto-N-sec-butyl-pyrrolidine-3-carboxamide](/api/spectrum/6ySSg6lPt0b/structure.png?h=300&w=458 "1-[4-(2-chlorobenzyl)oxyphenyl]-5-keto-N-sec-butyl-pyrrolidine-3-carboxamide")
