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Structure

Ethacrynic acid L-cysteine adduct

CAS
51246-37-8
Catalog Number
ACM51246378
Category
Other Products
Molecular Weight
424.30
Molecular Formula
C16H19Cl2NO6S

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Specification

Synonyms
S-[2-[4-(Carboxymethoxy)-2,3-dichlorobenzoyl]butyl]-L-cysteine,
Cysteine-ethacrynic Acid; Cysteine-ethacrynic Acid Adduct; Ethacrynic Acid-cysteine Complex;
IUPAC Name
(2R)-2-amino-3-[2-[4-(carboxymethoxy)-2,3-dichlorobenzoyl]butylsulfanyl]propanoic acid
Canonical SMILES
CCC(CSCC(C(=O)O)N)C(=O)C1=C(C(=C(C=C1)OCC(=O)O)Cl)Cl
InChI Key
MBVLLFXKDHUWAH-HTLJXXAVSA-N
Exact Mass
423.03100
H-Bond Acceptor
8
H-Bond Donor
3
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