3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]-3-(4-chlorophenyl)propanoic acid

SpectraBase Compound ID	7nkiSSRFKYo
InChI	InChI=1S/C19H19BrClNO4/c1-2-12-3-8-17(15(20)9-12)26-11-18(23)22-16(10-19(24)25)13-4-6-14(21)7-5-13/h3-9,16H,2,10-11H2,1H3,(H,22,23)(H,24,25)
InChIKey	MXSHHDLBRORJAB-UHFFFAOYSA-N Google Search
Mol Weight	440.72 g/mol
Molecular Formula	C19H19BrClNO4
Exact Mass	439.018599 g/mol

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SpectraBase Spectrum ID	2DMekuJVWhA
Name	3-[2-(2-bromanyl-4-ethyl-phenoxy)ethanoylamino]-3-(4-chlorophenyl)propanoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H19BrClNO4
InChI	InChI=1S/C19H19BrClNO4/c1-2-12-3-8-17(15(20)9-12)26-11-18(23)22-16(10-19(24)25)13-4-6-14(21)7-5-13/h3-9,16H,2,10-11H2,1H3,(H,22,23)(H,24,25)
InChIKey	MXSHHDLBRORJAB-UHFFFAOYSA-N
Molecular Weight	440.721 g/mol
SMILES	N(C(CC(=O)O)c1ccc(cc1)Cl)C(=O)COc1c(cc(cc1)CC)Br
SPLASH	splash10-0h01-2921000000-ed5bc22192a5ac6565ed
Synonyms	3-[[2-(2-bromo-4-ethyl-phenoxy)acetyl]amino]-3-(4-chlorophenyl)propanoic acid 3-[[2-(2-bromo-4-ethylphenoxy)-1-oxoethyl]amino]-3-(4-chlorophenyl)propanoic acid 3-[[2-(2-bromo-4-ethylphenoxy)acetyl]amino]-3-(4-chlorophenyl)propanoic acid
Wiley ID	1445500