2-[2-[2-(3,4-dichlorophenyl)ethanoyl-methyl-amino]-4-methylsulfinyl-butoxy]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[2-[2-(3,4-dichlorophenyl)ethanoyl-methyl-amino]-4-methylsulfinyl-butoxy]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[2-[[2-(3,4-dichlorophenyl)acetyl]-methyl-amino]-4-methylsulfinyl-butoxy]-2-oxo-acetic acid CAS Name: 2-[2-[[2-(3,4-dichlorophenyl)-1-oxoethyl]-methylamino]-4-methylsulfinylbutoxy]-2-oxoacetic acid IUPAC Name: 2-[2-[[2-(3,4-dichlorophenyl)acetyl]-methylamino]-4-methylsulfinylbutoxy]-2-oxoacetic acid Traditional Name: 2-[2-[[2-(3,4-dichlorophenyl)acetyl]-methyl-amino]-4-methylsulfinyl-butoxy]-2-keto-acetic acid Formula: C16H19Cl2NO6S MolecularWeight: 424.29616

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CCS(=O)C)COC(=O)C(=O)O)C(=O)CC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CN(C(CCS(=O)C)COC(=O)C(=O)O)C(=O)CC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H19Cl2NO6S/c1-19(14(20)8-10-3-4-12(17)13(18)7-10)11(5-6-26(2)24)9-25-16(23)15(21)22/h3-4,7,11H,5-6,8-9H2,1-2H3,(H,21,22)