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N-{4-[acetyl(methyl)amino]phenyl}-2-(3-isopropoxyphenyl)-4-quinolinecarboxamide

View entire compound with spectra: 2 NMR

N-{4-[acetyl(methyl)amino]phenyl}-2-(3-isopropoxyphenyl)-4-quinolinecarboxamide
SpectraBase Compound ID 8T5By73LAlk
InChI InChI=1S/C28H27N3O3/c1-18(2)34-23-9-7-8-20(16-23)27-17-25(24-10-5-6-11-26(24)30-27)28(33)29-21-12-14-22(15-13-21)31(4)19(3)32/h5-18H,1-4H3,(H,29,33)
InChIKey AVYIQAZAFPPJMR-UHFFFAOYSA-N
Mol Weight 453.54 g/mol
Molecular Formula C28H27N3O3
Exact Mass 453.205242 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID QWSLkaObwM
Name N-{4-[Acetyl(methyl)amino]phenyl}-2-(3-isopropoxyphenyl)-4-quinolinecarboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.205241738 u
Formula C28H27N3O3
InChI InChI=1S/C28H27N3O3/c1-18(2)34-23-9-7-8-20(16-23)27-17-25(24-10-5-6-11-26(24)30-27)28(33)29-21-12-14-22(15-13-21)31(4)19(3)32/h5-18H,1-4H3,(H,29,33)
InChIKey AVYIQAZAFPPJMR-UHFFFAOYSA-N
Molecular Weight 453.542 g/mol
SMILES N(C1=CC=C(N(C(=O)C)C)C=C1)C(C1=CC(C2=CC(OC(C)C)=CC=C2)=NC=2C1=CC=CC2)=O