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Benzoic acid, 4-[[[2-[[4-(methoxycarbonyl)phenyl]amino]-2-oxoethyl]sulfonyl]amino]-, methyl ester
SpectraBase Compound ID HSbim4S8a8h
InChI InChI=1S/C18H18N2O7S/c1-26-17(22)12-3-7-14(8-4-12)19-16(21)11-28(24,25)20-15-9-5-13(6-10-15)18(23)27-2/h3-10,20H,11H2,1-2H3,(H,19,21)
InChIKey HPBORCOMEHYJEY-UHFFFAOYSA-N
Mol Weight 406.41 g/mol
Molecular Formula C18H18N2O7S
Exact Mass 406.083472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSPpKz9XdwJ
Name Benzoic acid, 4-[[[2-[[4-(methoxycarbonyl)phenyl]amino]-2-oxoethyl]sulfonyl]amino]-, methyl ester
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Formula C18H18N2O7S
InChI InChI=1S/C18H18N2O7S/c1-26-17(22)12-3-7-14(8-4-12)19-16(21)11-28(24,25)20-15-9-5-13(6-10-15)18(23)27-2/h3-10,20H,11H2,1-2H3,(H,19,21)
InChIKey HPBORCOMEHYJEY-UHFFFAOYSA-N
Molecular Weight 406.409 g/mol
SMILES N(c1ccc(C(OC)=O)cc1)C(CS(=O)(=O)Nc1ccc(cc1)C(=O)OC)=O
SPLASH splash10-0udi-1900100000-e8f86869d1fba7c888eb
Source of Spectrum JX-2015-4-90
Synonyms Methyl 4-(2-((4-(methoxycarbonyl)phenyl)amino)-2-oxoethylsulfonamido)benzoate Methyl 4-{[(2-{[4-(methoxycarbonyl)phenyl]amino}-2-oxoethyl)sulfonyl]amino}benzoate 4-[[2-[(4-methoxycarbonylphenyl)sulfamoyl]-1-oxoethyl]amino]benzoic acid methyl ester Methyl 4-[[2-[(4-methoxycarbonylphenyl)sulfamoyl]acetyl]amino]benzoate Methyl 4-[2-[(4-methoxycarbonylphenyl)sulfamoyl]ethanoylamino]benzoate
Wiley ID 1725542