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N-(4-fluorobenzyl)-2-(4-isopropoxyphenyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

N-(4-fluorobenzyl)-2-(4-isopropoxyphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID 4rR53TTOf7h
InChI InChI=1S/C26H23FN2O2/c1-17(2)31-21-13-9-19(10-14-21)25-15-23(22-5-3-4-6-24(22)29-25)26(30)28-16-18-7-11-20(27)12-8-18/h3-15,17H,16H2,1-2H3,(H,28,30)
InChIKey XWWWAYIFQHXSDS-UHFFFAOYSA-N
Mol Weight 414.48 g/mol
Molecular Formula C26H23FN2O2
Exact Mass 414.174356 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DrPRV6Vxgjl
Name N-(4-Fluorobenzyl)-2-(4-isopropoxyphenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.174356150 u
Formula C26H23FN2O2
InChI InChI=1S/C26H23FN2O2/c1-17(2)31-21-13-9-19(10-14-21)25-15-23(22-5-3-4-6-24(22)29-25)26(30)28-16-18-7-11-20(27)12-8-18/h3-15,17H,16H2,1-2H3,(H,28,30)
InChIKey XWWWAYIFQHXSDS-UHFFFAOYSA-N
Molecular Weight 414.480 g/mol
SMILES N(CC1=CC=C(F)C=C1)C(C1=CC(C2=CC=C(OC(C)C)C=C2)=NC=2C1=CC=CC2)=O