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3-(2-isoindolinyl)-4-phenoxy-5-sulfamoylbenzoic acid, methyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

3-(2-isoindolinyl)-4-phenoxy-5-sulfamoylbenzoic acid, methyl ester
SpectraBase Compound ID KmzNpFjTCYM
InChI InChI=1S/C22H20N2O5S/c1-28-22(25)17-11-19(24-13-15-7-5-6-8-16(15)14-24)21(20(12-17)30(23,26)27)29-18-9-3-2-4-10-18/h2-12H,13-14H2,1H3,(H2,23,26,27)
InChIKey FKYPHMQCVSPDFK-UHFFFAOYSA-N
Mol Weight 424.47 g/mol
Molecular Formula C22H20N2O5S
Exact Mass 424.109293 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 76ckQRl8O5R
Name 3-(2-ISOINDOLINYL)-4-PHENOXY-5-SULFAMOYLBENZOIC ACID, METHYL ESTER
Source of Sample D. Bormann, W. Merkel and D. Mania, Hoechst Aktiengesellschaft, Frankfurt/Main, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N2O5S
InChI InChI=1S/C22H20N2O5S/c1-28-22(25)17-11-19(24-13-15-7-5-6-8-16(15)14-24)21(20(12-17)30(23,26)27)29-18-9-3-2-4-10-18/h2-12H,13-14H2,1H3,(H2,23,26,27)
InChIKey FKYPHMQCVSPDFK-UHFFFAOYSA-N
Literature Reference LIEBIGS ANN. CHEM. 1979, 461 Abstract-Chemical Abstracts= 91, 56738(1979)
Molecular Weight 424.471008
Synonyms BENZOIC ACID, 3-/2-ISOINDOLINYL/- 4-PHENOXY-5-SULFAMOYL-, METHYL ESTER
Technique KBr WAFER