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4-{3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide

View entire compound with spectra: 1 NMR

4-{3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
SpectraBase Compound ID 1jm70iWTTfJ
InChI InChI=1S/C33H33BrClN3O4/c1-18-6-11-28(36-16-18)38-32(40)29-19(2)37-24-14-33(3,4)15-25(39)31(24)30(29)20-7-9-26(41-5)21(12-20)17-42-27-10-8-22(34)13-23(27)35/h6-13,16,30,37H,14-15,17H2,1-5H3,(H,36,38,40)
InChIKey JFSQNBWWBQCNKS-UHFFFAOYSA-N
Mol Weight 651.0 g/mol
Molecular Formula C33H33BrClN3O4
Exact Mass 649.134297 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7smspAlPVUS
Name 4-{3-[(4-bromo-2-chlorophenoxy)methyl]-4-methoxyphenyl}-2,7,7-trimethyl-N-(5-methyl-2-pyridinyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
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/C33H33BrClN3O4/c1-18-6-11-28(36-16-18)38-32(40)29-19(2)37-24-14-33(3,4)15-25(39)31(24)30(29)20-7-9-26(41-5)21(12-20)17-42-27-10-8-22(34)13-23(27)35/h6-13,16,30,37H,14-15,17H2,1-5H3,(H,36,38,40)
InChIKey JFSQNBWWBQCNKS-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2542
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/9131332; Labnumber: ARC-04/1084; UZI_ID: UZI-002544
Temperature 313 °C