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2,4-Dichloro-N-[1-(4-chlorobenzyl)-2-oxoazepan-3-yl]benzamide

View entire compound with spectra: 1 NMR

2,4-Dichloro-N-[1-(4-chlorobenzyl)-2-oxoazepan-3-yl]benzamide
SpectraBase Compound ID 6NKF5ZupP1x
InChI InChI=1S/C20H19Cl3N2O2/c21-14-6-4-13(5-7-14)12-25-10-2-1-3-18(20(25)27)24-19(26)16-9-8-15(22)11-17(16)23/h4-9,11,18H,1-3,10,12H2,(H,24,26)
InChIKey LCQDELJMUJVENT-UHFFFAOYSA-N
Mol Weight 425.74 g/mol
Molecular Formula C20H19Cl3N2O2
Exact Mass 424.051211 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID qB1qlrGKk4
Name 2,4-Dichloro-N-[1-(4-chlorobenzyl)-2-oxoazepan-3-yl]benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 424.051210958 u
Formula C20H19Cl3N2O2
InChI InChI=1S/C20H19Cl3N2O2/c21-14-6-4-13(5-7-14)12-25-10-2-1-3-18(20(25)27)24-19(26)16-9-8-15(22)11-17(16)23/h4-9,11,18H,1-3,10,12H2,(H,24,26)
InChIKey LCQDELJMUJVENT-UHFFFAOYSA-N
Molecular Weight 425.743 g/mol
SMILES C(C1=C(C=C(C=C1)Cl)Cl)(=O)NC1C(N(CCCC1)CC1=CC=C(C=C1)Cl)=O