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2-(2,4-dimethoxyphenyl)-N-[3-({[2-(2,4-dimethoxyphenyl)-4-quinolinyl]carbonyl}amino)-2,2-dimethylpropyl]-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

2-(2,4-dimethoxyphenyl)-N-[3-({[2-(2,4-dimethoxyphenyl)-4-quinolinyl]carbonyl}amino)-2,2-dimethylpropyl]-4-quinolinecarboxamide
SpectraBase Compound ID 3JNYSEqlzVi
InChI InChI=1S/C41H40N4O6/c1-41(2,23-42-39(46)31-21-35(44-33-13-9-7-11-27(31)33)29-17-15-25(48-3)19-37(29)50-5)24-43-40(47)32-22-36(45-34-14-10-8-12-28(32)34)30-18-16-26(49-4)20-38(30)51-6/h7-22H,23-24H2,1-6H3,(H,42,46)(H,43,47)
InChIKey NFJUEQIBCKCNOY-UHFFFAOYSA-N
Mol Weight 684.8 g/mol
Molecular Formula C41H40N4O6
Exact Mass 684.294785 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3N68nkAYQ19
Name 2-(2,4-Dimethoxyphenyl)-N-[3-({[2-(2,4-dimethoxyphenyl)-4-quinolinyl]carbonyl}amino)-2,2-dimethylpropyl]-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 684.294785018 u
Formula C41H40N4O6
InChI InChI=1S/C41H40N4O6/c1-41(2,23-42-39(46)31-21-35(44-33-13-9-7-11-27(31)33)29-17-15-25(48-3)19-37(29)50-5)24-43-40(47)32-22-36(45-34-14-10-8-12-28(32)34)30-18-16-26(49-4)20-38(30)51-6/h7-22H,23-24H2,1-6H3,(H,42,46)(H,43,47)
InChIKey NFJUEQIBCKCNOY-UHFFFAOYSA-N
Molecular Weight 684.793 g/mol
SMILES N(C(C1=CC(=NC=2C=CC=CC12)C=1C(=CC(=CC1)OC)OC)=O)CC(CNC(C1=CC(C=2C(=CC(=CC2)OC)OC)=NC2=C1C=CC=C2)=O)(C)C