methyl 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[4-[2,4-bis(chloranyl)phenoxy]butanoylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[4-(2,4-dichlorophenoxy)butanoylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[4-(2,4-dichlorophenoxy)-1-oxobutyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[4-(2,4-dichlorophenoxy)butanoylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[4-(2,4-dichlorophenoxy)butanoylamino]-4-(methylthio)butyric acid methyl ester Formula: C16H21Cl2NO4S MolecularWeight: 394.31324

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

COC(=O)C(CCSC)NC(=O)CCCOC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H21Cl2NO4S/c1-22-16(21)13(7-9-24-2)19-15(20)4-3-8-23-14-6-5-11(17)10-12(14)18/h5-6,10,13H,3-4,7-9H2,1-2H3,(H,19,20)