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Benzeneacetic acid, .alpha.-hydroxy-4-[methyl[(phenylamino)carbonyl]amino]-.alpha.-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID ImYT7TazN8G
InChI InChI=1S/C18H17F3N2O4/c1-23(16(25)22-13-6-4-3-5-7-13)14-10-8-12(9-11-14)17(26,15(24)27-2)18(19,20)21/h3-11,26H,1-2H3,(H,22,25)
InChIKey PTVTVOXBCWOETJ-UHFFFAOYSA-N
Mol Weight 382.34 g/mol
Molecular Formula C18H17F3N2O4
Exact Mass 382.114042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8VXpDSm8124
Name Benzeneacetic acid, .alpha.-hydroxy-4-[methyl[(phenylamino)carbonyl]amino]-.alpha.-(trifluoromethyl)-, methyl ester
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Formula C18H17F3N2O4
InChI InChI=1S/C18H17F3N2O4/c1-23(16(25)22-13-6-4-3-5-7-13)14-10-8-12(9-11-14)17(26,15(24)27-2)18(19,20)21/h3-11,26H,1-2H3,(H,22,25)
InChIKey PTVTVOXBCWOETJ-UHFFFAOYSA-N
Molecular Weight 382.339 g/mol
SMILES N(C(N(c1ccc(C(C(F)(F)F)(C(=O)OC)O)cc1)C)=O)c1ccccc1
SPLASH splash10-0kai-6961000000-3bf9b442fb8b0b1b29fd
Source of Spectrum IY-2-4880-2
Synonyms Methyl 3,3,3-trifluoro-2-hydroxy-2-{4-[methyl(phenylcarbamoyl)amino]phenyl}propanoate 2-[4-[[anilino(oxo)methyl]-methylamino]phenyl]-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester Methyl 3,3,3-trifluoro-2-hydroxy-2-[4-[methyl(phenylcarbamoyl)amino]phenyl]propanoate Methyl 3,3,3-tris(fluoranyl)-2-[4-[methyl(phenylcarbamoyl)amino]phenyl]-2-oxidanyl-propanoate
Wiley ID 1656559