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Methyl 2-(4-{[(3-chlorophenyl)carbamoyl]amino}-3-methoxyphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
SpectraBase Compound ID BEDkawOU0WD
InChI InChI=1S/C18H16ClF3N2O5/c1-28-14-8-10(17(27,15(25)29-2)18(20,21)22)6-7-13(14)24-16(26)23-12-5-3-4-11(19)9-12/h3-9,27H,1-2H3,(H2,23,24,26)
InChIKey SZJVYFYSRSYWNT-UHFFFAOYSA-N
Mol Weight 432.78 g/mol
Molecular Formula C18H16ClF3N2O5
Exact Mass 432.069984 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jp8ACIEAF38
Name Methyl 2-(4-{[(3-chlorophenyl)carbamoyl]amino}-3-methoxyphenyl)-3,3,3-trifluoro-2-hydroxypropanoate
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Formula C18H16ClF3N2O5
InChI InChI=1S/C18H16ClF3N2O5/c1-28-14-8-10(17(27,15(25)29-2)18(20,21)22)6-7-13(14)24-16(26)23-12-5-3-4-11(19)9-12/h3-9,27H,1-2H3,(H2,23,24,26)
InChIKey SZJVYFYSRSYWNT-UHFFFAOYSA-N
Molecular Weight 432.783 g/mol
SMILES OC(c1ccc(c(c1)OC)NC(=O)Nc1cc(ccc1)Cl)(C(F)(F)F)C(OC)=O
SPLASH splash10-00fr-3950100000-cd6d319c4fe070ba71c8
Source of Spectrum IY-2-5046-3
Synonyms 2-[4-[[(3-chloroanilino)-oxomethyl]amino]-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoic acid methyl ester Methyl 2-[4-[(3-chlorophenyl)carbamoylamino]-3-methoxyphenyl]-3,3,3-trifluoro-2-hydroxypropanoate Methyl 2-[4-[(3-chlorophenyl)carbamoylamino]-3-methoxy-phenyl]-3,3,3-trifluoro-2-hydroxy-propanoate Methyl 2-[4-[(3-chlorophenyl)carbamoylamino]-3-methoxy-phenyl]-3,3,3-tris(fluoranyl)-2-oxidanyl-propanoate
Wiley ID 1658446