3-{[(dimethylamino)methylene]sulfamoyl}-4-phenoxy-5-(1-pyrolidinyl)benzoic acid, methyl ester

SpectraBase Compound ID	9wDartck4bJ
InChI	InChI=1S/C21H25N3O5S/c1-23(2)15-22-30(26,27)19-14-16(21(25)28-3)13-18(24-11-7-8-12-24)20(19)29-17-9-5-4-6-10-17/h4-6,9-10,13-15H,7-8,11-12H2,1-3H3/b22-15+
InChIKey	HBDOTWMVKQPCIB-PXLXIMEGSA-N Google Search
Mol Weight	431.51 g/mol
Molecular Formula	C21H25N3O5S
Exact Mass	431.151492 g/mol

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SpectraBase Spectrum ID	3y2VKqsdFyx
Name	3-{[(DIMETHYLAMINO)METHYLENE]SULFAMOYL}-4-PHENOXY-5-(1-PYRROLIDINYL)BENZOIC ACID, METHYL ESTER
Source of Sample	D. Bormann, W. Merkel and D. Mania, Hoechst Aktiengesellschaft, Frankfurt/Main, Germany
CAS Registry Number	60376-76-3
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H25N3O5S
InChI	InChI=1S/C21H25N3O5S/c1-23(2)15-22-30(26,27)19-14-16(21(25)28-3)13-18(24-11-7-8-12-24)20(19)29-17-9-5-4-6-10-17/h4-6,9-10,13-15H,7-8,11-12H2,1-3H3/b22-15+
InChIKey	HBDOTWMVKQPCIB-PXLXIMEGSA-N
Literature Reference	LIEBIGS ANN. CHEM. 1979, 461 Abstract-Chemical Abstracts= 91, 56738(1979)
Molecular Weight	431.506989
Synonyms	BENZOIC ACID, 3-///DIMETHYLAMINO/- METHYLENE/SULFAMOYL/-4-PHENOXY- 5-/1-PYRROLIDINYL/-, METHYL ESTER
Technique	FILM (CAST FROM CHCl3)