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N-(4-chlorophenyl)-4-[(2E)-3-phenyl-2-propenyl]-1-piperazinecarboxamide

View entire compound with spectra: 2 NMR

N-(4-chlorophenyl)-4-[(2E)-3-phenyl-2-propenyl]-1-piperazinecarboxamide
SpectraBase Compound ID Ghellkwp4QZ
InChI InChI=1S/C20H22ClN3O/c21-18-8-10-19(11-9-18)22-20(25)24-15-13-23(14-16-24)12-4-7-17-5-2-1-3-6-17/h1-11H,12-16H2,(H,22,25)/b7-4+
InChIKey MJJSXOJHTIYOCJ-QPJJXVBHSA-N
Mol Weight 355.87 g/mol
Molecular Formula C20H22ClN3O
Exact Mass 355.14514 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6ZFSRO7T84n
Name N-(4-Chlorophenyl)-4-[(2E)-3-phenyl-2-propenyl]-1-piperazinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 355.145140039 u
Formula C20H22ClN3O
InChI InChI=1S/C20H22ClN3O/c21-18-8-10-19(11-9-18)22-20(25)24-15-13-23(14-16-24)12-4-7-17-5-2-1-3-6-17/h1-11H,12-16H2,(H,22,25)/b7-4+
InChIKey MJJSXOJHTIYOCJ-QPJJXVBHSA-N
Molecular Weight 355.869 g/mol
SMILES N(C(N1CCN(CC1)C\C=C\C=1C=CC=CC1)=O)C1=CC=C(Cl)C=C1