SpectraBase Spectrum ID |
3nQ938DKRBr |
Name |
2-Piperazinone, 4-(4-bromobenzoyl)-3-[2-[4-(4-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
514.121568361 u |
Formula |
C24H27BrN4O4 |
InChI |
InChI=1S/C24H27BrN4O4/c1-33-20-8-6-19(7-9-20)27-12-14-28(15-13-27)22(30)16-21-23(31)26-10-11-29(21)24(32)17-2-4-18(25)5-3-17/h2-9,21H,10-16H2,1H3,(H,26,31) |
InChIKey |
IEORNYFJIXNFRA-UHFFFAOYSA-N |
Molecular Weight |
515.408 g/mol |
SMILES |
N1C(C(N(CC1)C(C1=CC=C(C=C1)Br)=O)CC(N1CCN(CC1)C=1C=CC(=CC1)OC)=O)=O |