SpectraBase Spectrum ID |
7GjQQmRLhVN |
Name |
1-[(2E)-3-(1,3-Benzodioxol-5-yl)-2-propenoyl]-4-[2-oxo-2-(1-pyrrolidinyl)ethyl]piperazine |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
371.184506293 u |
Formula |
C20H25N3O4 |
InChI |
InChI=1S/C20H25N3O4/c24-19(6-4-16-3-5-17-18(13-16)27-15-26-17)23-11-9-21(10-12-23)14-20(25)22-7-1-2-8-22/h3-6,13H,1-2,7-12,14-15H2/b6-4+ |
InChIKey |
PZMLVXOVOLQCMP-GQCTYLIASA-N |
Molecular Weight |
371.437 g/mol |
SMILES |
C(\C=C\C1=CC2=C(C=C1)OCO2)(=O)N1CCN(CC1)CC(=O)N1CCCC1 |