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Methyl 4-(4-[(4-fluoroanilino)sulfonyl]anilino)-4-oxobutanoate
SpectraBase Compound ID D3g9iwkN2m7
InChI InChI=1S/C17H17FN2O5S/c1-25-17(22)11-10-16(21)19-13-6-8-15(9-7-13)26(23,24)20-14-4-2-12(18)3-5-14/h2-9,20H,10-11H2,1H3,(H,19,21)
InChIKey DTMOWMFCVIOUNT-UHFFFAOYSA-N
Mol Weight 380.39 g/mol
Molecular Formula C17H17FN2O5S
Exact Mass 380.084221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Diz7SZD3Mu
Name Methyl 4-(4-[(4-fluoroanilino)sulfonyl]anilino)-4-oxobutanoate
CAS Registry Number 327070-71-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17FN2O5S
InChI InChI=1S/C17H17FN2O5S/c1-25-17(22)11-10-16(21)19-13-6-8-15(9-7-13)26(23,24)20-14-4-2-12(18)3-5-14/h2-9,20H,10-11H2,1H3,(H,19,21)
InChIKey DTMOWMFCVIOUNT-UHFFFAOYSA-N
Molecular Weight 380.390 g/mol
SMILES N(C(=O)CCC(OC)=O)c1ccc(S(=O)(Nc2ccc(cc2)F)=O)cc1
SPLASH splash10-07w9-5931000000-b6452fd3b86db3873e7e
Synonyms 4-[4-[(4-fluorophenyl)sulfamoyl]anilino]-4-keto-butyric acid methyl ester 4-[4-[(4-fluorophenyl)sulfamoyl]anilino]-4-oxobutanoic acid methyl ester Methyl 4-[4-[(4-fluorophenyl)sulfamoyl]anilino]-4-oxo-butanoate Methyl 4-[[4-[(4-fluorophenyl)sulfamoyl]phenyl]amino]-4-oxidanylidene-butanoate N-[4-(4-Fluoro-phenylsulfamoyl)-phenyl]-succinamic acid methyl ester
Wiley ID 1460521