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Benzeneacetic acid, .alpha.-hydroxy-4-[[(2-naphthalenylamino)carbonyl]amino]-.alpha.-(trifluoromethyl)-, ethyl ester
SpectraBase Compound ID CpZKaPZt7PF
InChI InChI=1S/C22H19F3N2O4/c1-2-31-19(28)21(30,22(23,24)25)16-8-11-17(12-9-16)26-20(29)27-18-10-7-14-5-3-4-6-15(14)13-18/h3-13,30H,2H2,1H3,(H2,26,27,29)
InChIKey BOACLTDBJCQNJQ-UHFFFAOYSA-N
Mol Weight 432.4 g/mol
Molecular Formula C22H19F3N2O4
Exact Mass 432.129692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ek0b81wA7ud
Name Benzeneacetic acid, .alpha.-hydroxy-4-[[(2-naphthalenylamino)carbonyl]amino]-.alpha.-(trifluoromethyl)-, ethyl ester
Alternate Name(s) Ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-{[(naphthalen-2-yl)carbamoyl]amino}phenyl)propanoate 3,3,3-trifluoro-2-hydroxy-2-[4-[[(2-naphthalenylamino)-oxomethyl]amino]phenyl]propanoic acid ethyl ester Ethyl 3,3,3-trifluoro-2-hydroxy-2-[4-(naphthalen-2-ylcarbamoylamino)phenyl]propanoate Ethyl 3,3,3-trifluoro-2-hydroxy-2-[4-(2-naphthylcarbamoylamino)phenyl]propanoate Ethyl 3,3,3-tris(fluoranyl)-2-[4-(naphthalen-2-ylcarbamoylamino)phenyl]-2-oxidanyl-propanoate
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Formula C22H19F3N2O4
InChI InChI=1S/C22H19F3N2O4/c1-2-31-19(28)21(30,22(23,24)25)16-8-11-17(12-9-16)26-20(29)27-18-10-7-14-5-3-4-6-15(14)13-18/h3-13,30H,2H2,1H3,(H2,26,27,29)
InChIKey BOACLTDBJCQNJQ-UHFFFAOYSA-N
Molecular Weight 432.399 g/mol
SMILES OC(c1ccc(cc1)NC(=O)Nc1cc2c(cc1)cccc2)(C(F)(F)F)C(OCC)=O
SPLASH splash10-0006-1900200000-c4a587793af36e9efb08
Source of Spectrum IY-2-5035-4
Wiley ID 1658337