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Benzeneacetic acid, 4-[[[[1-(ethoxycarbonyl)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino]carbonyl]amino]-.alpha.-hydroxy-3-methyl-.alpha.-(trifluoromethyl)-, ethyl ester
SpectraBase Compound ID 9YvKwKPmaqz
InChI InChI=1S/C24H23F7N2O6/c1-4-38-18(34)21(23(26,27)28,14-6-9-16(25)10-7-14)33-20(36)32-17-11-8-15(12-13(17)3)22(37,24(29,30)31)19(35)39-5-2/h6-12,37H,4-5H2,1-3H3,(H2,32,33,36)
InChIKey RDSSXVKZBLGSJA-UHFFFAOYSA-N
Mol Weight 568.44 g/mol
Molecular Formula C24H23F7N2O6
Exact Mass 568.144434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3NKsDWoQ1A
Name Benzeneacetic acid, 4-[[[[1-(ethoxycarbonyl)-2,2,2-trifluoro-1-(4-fluorophenyl)ethyl]amino]carbonyl]amino]-.alpha.-hydroxy-3-methyl-.alpha.-(trifluoromethyl)-, ethyl ester
Alternate Name(s) Ethyl 2-({[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]carbamoyl}amino)-3,3,3-trifluoro-2-(4-fluorophenyl)propanoate 2-[[[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylanilino]-oxomethyl]amino]-3,3,3-trifluoro-2-(4-fluorophenyl)propanoic acid ethyl ester Ethyl 2-[[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)-2-methylphenyl]carbamoylamino]-3,3,3-trifluoro-2-(4-fluorophenyl)propanoate Ethyl 2-[[4-(1-ethoxycarbonyl-2,2,2-trifluoro-1-hydroxy-ethyl)-2-methyl-phenyl]carbamoylamino]-3,3,3-trifluoro-2-(4-fluorophenyl)propanoate Ethyl 2-[[4-[3-ethoxy-1,1,1-tris(fluoranyl)-2-oxidanyl-3-oxidanylidene-propan-2-yl]-2-methyl-phenyl]carbamoylamino]-3,3,3-tris(fluoranyl)-2-(4-fluorophenyl)propanoate
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Formula C24H23F7N2O6
InChI InChI=1S/C24H23F7N2O6/c1-4-38-18(34)21(23(26,27)28,14-6-9-16(25)10-7-14)33-20(36)32-17-11-8-15(12-13(17)3)22(37,24(29,30)31)19(35)39-5-2/h6-12,37H,4-5H2,1-3H3,(H2,32,33,36)
InChIKey RDSSXVKZBLGSJA-UHFFFAOYSA-N
Molecular Weight 568.445 g/mol
SMILES N(C(C(OCC)=O)(C(F)(F)F)c1ccc(cc1)F)C(=O)Nc1c(cc(C(O)(C(F)(F)F)C(OCC)=O)cc1)C
SPLASH splash10-0zgi-3960000000-de29f9e650e153f451c4
Source of Spectrum IY-2-5041-5
Wiley ID 1658398