N-{3-[3-(Acetylamino)phenoxy]propyl}-3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamide

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Systematic / IUPAC Name: N-[3-(3-Acetamidophenoxy)propyl]-3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

ID: Reference4063

Other Names: 3-(2-Chloro-6-fluorophenyl)-N-[3-(3-acetamidophenoxy)propyl]-5-methyl-1,2-oxazole-4-carboxamide

Formula: C22H21ClFN3O4

Spectral Data

N-{3-[3-(Acetylamino)phenoxy]propyl}-3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/4/2016 7:02:48 AM
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Identificators

InChI InChI=1S/C22H21ClFN3O4/c1-13-19(21(27-31-13)20-17(23)8-4-9-18(20)24)22(29)25-10-5-11-30-16-7-3-6-15(12-16)26-14(2)28/h3-4,6-9,12H,5,10-11H2,1-2H3,(H,25,29)(H,26,28)
InChI Key GMNFRAOTCOWMCO-UHFFFAOYSA-N
Canonical SMILES CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)NCCCOC3=CC=CC(=C3)NC(=O)C
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Other Names 3-(2-Chloro-6-fluorophenyl)-N-[3-(3-acetamidophenoxy)propyl]-5-methyl-1,2-oxazole-4-carboxamide

In Other Databases

ChemSpider 2089250
PubChem 2810835