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N-[4,5-Dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-3-[2-(2,4-di-tert-pentylphenoxy)acetamido]benzamide
SpectraBase Compound ID 91aPaluDLvI
InChI InChI=1S/C34H37Cl3N4O4/c1-7-33(3,4)21-12-13-27(24(15-21)34(5,6)8-2)45-19-29(42)38-23-11-9-10-20(14-23)32(44)39-28-18-30(43)41(40-28)31-25(36)16-22(35)17-26(31)37/h9-17H,7-8,18-19H2,1-6H3,(H,38,42)(H,39,40,44)
InChIKey QDIMMGOJTIUSOA-UHFFFAOYSA-N
Mol Weight 672.1 g/mol
Molecular Formula C34H37Cl3N4O4
Exact Mass 670.188039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqfpYxEyJwG
Name Benzamide, 3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[4,5-dihydro-5-oxo-1-(2,4,6-trichlorophenyl)-1H-pyrazol-3-yl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H37Cl3N4O4
InChI InChI=1S/C34H37Cl3N4O4/c1-7-33(3,4)21-12-13-27(24(15-21)34(5,6)8-2)45-19-29(42)38-23-11-9-10-20(14-23)32(44)39-28-18-30(43)41(40-28)31-25(36)16-22(35)17-26(31)37/h9-17H,7-8,18-19H2,1-6H3,(H,38,42)(H,39,40,44)
InChIKey QDIMMGOJTIUSOA-UHFFFAOYSA-N
Molecular Weight 672.053 g/mol
SMILES N(C(COc1ccc(C(CC)(C)C)cc1C(C)(C)CC)=O)c1cccc(C(=O)NC2=NN(C(=O)C2)c2c(Cl)cc(Cl)cc2Cl)c1
SPLASH splash10-000x-6913005000-f68b95c53f6ddece2625
Source of Spectrum JX-2015-4-1415
Synonyms 3-(2-(2,4-di-tert-pentylphenoxy)acetamido)-N-(5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl)benzamide 3-({[2,4-bis(2-methylbutan-2-yl)phenoxy]acetyl}amino)-N-[5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]benzamide 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-oxoethyl]amino]-N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide 3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]acetyl]amino]-N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide 3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]acetyl]amino]-N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]benzamide 3-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]ethanoylamino]-N-[5-oxidanylidene-1-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-3-yl]benzamide
Wiley ID 1726803