3-(4-isopropoxyphenyl)-3-[[2-(2-thienyl)acetyl]amino]propanoic acid

SpectraBase Compound ID	4dQbM3B9ZYJ
InChI	InChI=1S/C18H21NO4S/c1-12(2)23-14-7-5-13(6-8-14)16(11-18(21)22)19-17(20)10-15-4-3-9-24-15/h3-9,12,16H,10-11H2,1-2H3,(H,19,20)(H,21,22)
InChIKey	BWJWWHYPCMZQSF-UHFFFAOYSA-N Google Search
Mol Weight	347.43 g/mol
Molecular Formula	C18H21NO4S
Exact Mass	347.119129 g/mol

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SpectraBase Spectrum ID	E3QkAjW2hCD
Name	3-(4-isopropoxyphenyl)-3-[[2-(2-thienyl)acetyl]amino]propanoic acid
Alternate Name(s)	3-(4-isopropoxyphenyl)-3-[[2-(2-thienyl)acetyl]amino]propionic acid 3-(4-propan-2-yloxyphenyl)-3-(2-thiophen-2-ylethanoylamino)propanoic acid 3-(4-propan-2-yloxyphenyl)-3-[(2-thiophen-2-ylacetyl)amino]propanoic acid 3-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-(4-propan-2-yloxyphenyl)propanoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H21NO4S
InChI	InChI=1S/C18H21NO4S/c1-12(2)23-14-7-5-13(6-8-14)16(11-18(21)22)19-17(20)10-15-4-3-9-24-15/h3-9,12,16H,10-11H2,1-2H3,(H,19,20)(H,21,22)
InChIKey	BWJWWHYPCMZQSF-UHFFFAOYSA-N
Molecular Weight	347.429 g/mol
SMILES	OC(CC(c1ccc(cc1)OC(C)C)NC(=O)Cc1sccc1)=O
SPLASH	splash10-00dl-9720000000-0f59e0f1747dae6e958e
Wiley ID	1444224