2-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[2-[2,4-bis(chloranyl)phenoxy]propanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-(2,4-dichlorophenoxy)-1-oxopropyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[2-(2,4-dichlorophenoxy)propanoylamino]-4-(methylthio)butyric acid Formula: C14H17Cl2NO4S MolecularWeight: 366.26008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCSC)C(=O)O)OC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(CCSC)C(=O)O)OC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C14H17Cl2NO4S/c1-8(21-12-4-3-9(15)7-10(12)16)13(18)17-11(14(19)20)5-6-22-2/h3-4,7-8,11H,5-6H2,1-2H3,(H,17,18)(H,19,20)