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(2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-(3-cyano-4,6-dimethyl-2-oxo-1(2H)-pyridinyl)-2-propenamide
SpectraBase Compound ID JdigYWjSBtN
InChI InChI=1S/C25H22BrN3O4/c1-16-12-17(2)29(25(31)22(16)14-27)28-24(30)11-5-18-4-10-23(32-3)19(13-18)15-33-21-8-6-20(26)7-9-21/h4-13H,15H2,1-3H3,(H,28,30)/b11-5+
InChIKey ONPFLKTUWMLQFQ-VZUCSPMQSA-N
Mol Weight 508.37 g/mol
Molecular Formula C25H22BrN3O4
Exact Mass 507.079369 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Be6zJcmeRGl
Name (2E)-3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-(3-cyano-4,6-dimethyl-2-oxo-1(2H)-pyridinyl)-2-propenamide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H22BrN3O4/c1-16-12-17(2)29(25(31)22(16)14-27)28-24(30)11-5-18-4-10-23(32-3)19(13-18)15-33-21-8-6-20(26)7-9-21/h4-13H,15H2,1-3H3,(H,28,30)/b11-5+
InChIKey ONPFLKTUWMLQFQ-VZUCSPMQSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_11161
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1026520; Labnumber: MVY0377; UZI_ID: UZI-011163
Synonyms 3-{3-[(4-bromophenoxy)methyl]-4-methoxyphenyl}-N-(3-cyano-4,6-dimethyl-2-oxo-1(2H)-pyridinyl)-2-propenamide
Temperature 308 °C