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

View entire compound with spectra: 2 NMR

2-(4-ethoxyphenyl)-N-[3-({[2-(4-ethoxyphenyl)-4-quinolinyl]carbonyl}amino)-2,2-dimethylpropyl]-4-quinolinecarboxamide
SpectraBase Compound ID 6ytidcqhuqi
InChI InChI=1S/C41H40N4O4/c1-5-48-29-19-15-27(16-20-29)37-23-33(31-11-7-9-13-35(31)44-37)39(46)42-25-41(3,4)26-43-40(47)34-24-38(45-36-14-10-8-12-32(34)36)28-17-21-30(22-18-28)49-6-2/h7-24H,5-6,25-26H2,1-4H3,(H,42,46)(H,43,47)
InChIKey JUOVVVAVAAMALU-UHFFFAOYSA-N
Mol Weight 652.8 g/mol
Molecular Formula C41H40N4O4
Exact Mass 652.304956 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ykCRmjcfGt
Name 2-(4-Ethoxyphenyl)-N-[3-({[2-(4-ethoxyphenyl)-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 652.304955780 u
Formula C41H40N4O4
InChI InChI=1S/C41H40N4O4/c1-5-48-29-19-15-27(16-20-29)37-23-33(31-11-7-9-13-35(31)44-37)39(46)42-25-41(3,4)26-43-40(47)34-24-38(45-36-14-10-8-12-32(34)36)28-17-21-30(22-18-28)49-6-2/h7-24H,5-6,25-26H2,1-4H3,(H,42,46)(H,43,47)
InChIKey JUOVVVAVAAMALU-UHFFFAOYSA-N
SMILES N(C(C1=CC(C=2C=CC(=CC2)OCC)=NC2=C1C=CC=C2)=O)CC(CNC(C1=CC(C=2C=CC(=CC2)OCC)=NC2=C1C=CC=C2)=O)(C)C