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

*Links on SpectraBase are not permalinks.
N(1)-{4'-[3''-Cyano-2''-oxo-6''-(p-fluorophenyl)-1'',2''-dihydro-4''-pyridinyl]phenyl}-5-chloro-2-methoxybenzamide
SpectraBase Compound ID J7ZKq3a537v
InChI InChI=1S/C26H17ClFN3O3/c1-34-24-11-6-17(27)12-21(24)25(32)30-19-9-4-15(5-10-19)20-13-23(31-26(33)22(20)14-29)16-2-7-18(28)8-3-16/h2-13H,1H3,(H,30,32)(H,31,33)
InChIKey WQNKIWPKRPNOSU-UHFFFAOYSA-N
Mol Weight 473.89 g/mol
Molecular Formula C26H17ClFN3O3
Exact Mass 473.094247 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID DxrBEtFfEle
Name N(1)-{4'-[3''-Cyano-2''-oxo-6''-(p-fluorophenyl)-1'',2''-dihydro-4''-pyridinyl]phenyl}-5-chloro-2-methoxybenzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.094247279 u
Formula C26H17ClFN3O3
InChI InChI=1S/C26H17ClFN3O3/c1-34-24-11-6-17(27)12-21(24)25(32)30-19-9-4-15(5-10-19)20-13-23(31-26(33)22(20)14-29)16-2-7-18(28)8-3-16/h2-13H,1H3,(H,30,32)(H,31,33)
InChIKey WQNKIWPKRPNOSU-UHFFFAOYSA-N
Molecular Weight 473.891 g/mol
SMILES C1(=C(C=C(NC1=O)C1=CC=C(C=C1)F)C1=CC=C(NC(C=2C(=CC=C(C2)Cl)OC)=O)C=C1)C#N