SpectraBase Spectrum ID |
2khBvJxJshC |
Name |
N-[1-(4-Chlorophenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]-N-(2-oxidanyl-2-phenyl-ethyl)ethanamide |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
386.103334796 u |
Formula |
C20H19ClN2O4 |
InChI |
InChI=1S/C20H19ClN2O4/c1-13(24)22(12-18(25)14-5-3-2-4-6-14)17-11-19(26)23(20(17)27)16-9-7-15(21)8-10-16/h2-10,17-18,25H,11-12H2,1H3 |
InChIKey |
MVHKFIURSMGIOK-UHFFFAOYSA-N |
Molecular Weight |
386.835 g/mol |
SMILES |
C=1C=CC(C(CN(C2C(N(C(C2)=O)C=2C=CC(=CC2)Cl)=O)C(=O)C)O)=CC1 |