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Benzoic acid, 4-[[2-[(3,5-dichloro-4-hydroxyphenyl)amino]-4,4-dimethyl-1,3-dioxopentyl]amino]-
SpectraBase Compound ID 7WdrgWzCUYf
InChI InChI=1S/C20H20Cl2N2O5/c1-20(2,3)17(26)15(23-12-8-13(21)16(25)14(22)9-12)18(27)24-11-6-4-10(5-7-11)19(28)29/h4-9,15,23,25H,1-3H3,(H,24,27)(H,28,29)
InChIKey ZIJJWSLXJYKVRL-UHFFFAOYSA-N
Mol Weight 439.3 g/mol
Molecular Formula C20H20Cl2N2O5
Exact Mass 438.074927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1l9lOJ347MT
Name Benzoic acid, 4-[[2-[(3,5-dichloro-4-hydroxyphenyl)amino]-4,4-dimethyl-1,3-dioxopentyl]amino]-
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Formula C20H20Cl2N2O5
InChI InChI=1S/C20H20Cl2N2O5/c1-20(2,3)17(26)15(23-12-8-13(21)16(25)14(22)9-12)18(27)24-11-6-4-10(5-7-11)19(28)29/h4-9,15,23,25H,1-3H3,(H,24,27)(H,28,29)
InChIKey ZIJJWSLXJYKVRL-UHFFFAOYSA-N
Molecular Weight 439.295 g/mol
SMILES N(C(C(=O)Nc1ccc(C(O)=O)cc1)C(C(C)(C)C)=O)c1cc(c(c(c1)Cl)O)Cl
SPLASH splash10-0zmr-4916100000-b3594261bd4899bd903e
Source of Spectrum JX-2015-4-475
Synonyms 4-(2-((3,5-dichloro-4-hydroxyphenyl)amino)-4,4-dimethyl-3-oxopentanamido)benzoic acid 4-{[N-(3,5-dichloro-4-hydroxyphenyl)-4-methyl-3-oxoleucyl]amino}benzoic acid 4-[[2-(3,5-dichloro-4-hydroxyanilino)-4,4-dimethyl-1,3-dioxopentyl]amino]benzoic acid 4-[[2-(3,5-dichloro-4-hydroxyanilino)-4,4-dimethyl-3-oxopentanoyl]amino]benzoic acid 4-[[2-(3,5-dichloro-4-hydroxy-anilino)-4,4-dimethyl-3-oxo-pentanoyl]amino]benzoic acid 4-[[2-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]amino]-4,4-dimethyl-3-oxidanylidene-pentanoyl]amino]benzoic acid
Wiley ID 1725909