For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-(4-benzylpiperazin-1-yl)-N-ethyl-5-nitro-N-phenyl-benzamide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-(4-benzylpiperazin-1-yl)-N-ethyl-5-nitro-N-phenyl-benzamide
SpectraBase Compound ID 9xb2JgihJSi
InChI InChI=1S/C26H28N4O3/c1-2-29(22-11-7-4-8-12-22)26(31)24-19-23(30(32)33)13-14-25(24)28-17-15-27(16-18-28)20-21-9-5-3-6-10-21/h3-14,19H,2,15-18,20H2,1H3
InChIKey JGVZGMACXDYQEQ-UHFFFAOYSA-N
Mol Weight 444.54 g/mol
Molecular Formula C26H28N4O3
Exact Mass 444.216141 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9kE7iAUPrXM
Name 2-(4-Benzylpiperazin-1-yl)-N-ethyl-5-nitro-N-phenyl-benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.216140775 u
Formula C26H28N4O3
InChI InChI=1S/C26H28N4O3/c1-2-29(22-11-7-4-8-12-22)26(31)24-19-23(30(32)33)13-14-25(24)28-17-15-27(16-18-28)20-21-9-5-3-6-10-21/h3-14,19H,2,15-18,20H2,1H3
InChIKey JGVZGMACXDYQEQ-UHFFFAOYSA-N
Molecular Weight 444.535 g/mol
SMILES C=1(C(=CC(=CC1)N(=O)=O)C(N(C1=CC=CC=C1)CC)=O)N1CCN(CC1)CC1=CC=CC=C1