2-[(3,4-dichlorophenyl)sulfanylmethyl]-4-methoxy-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)sulfanylmethyl]-4-methoxy-4-oxidanylidene-butanoic acid Openeye Name: 2-[(3,4-dichlorophenyl)sulfanylmethyl]-4-methoxy-4-oxo-butanoic acid CAS Name: 2-[[(3,4-dichlorophenyl)thio]methyl]-4-methoxy-4-oxobutanoic acid IUPAC Name: 2-[(3,4-dichlorophenyl)sulfanylmethyl]-4-methoxy-4-oxobutanoic acid Traditional Name: 2-[[(3,4-dichlorophenyl)thio]methyl]-4-keto-4-methoxy-butyric acid Formula: C12H12Cl2O4S MolecularWeight: 323.19228

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CSC1=CC(=C(C=C1)Cl)Cl)C(=O)O

Isomeric SMILES

COC(=O)CC(CSC1=CC(=C(C=C1)Cl)Cl)C(=O)O

InChI

InChI=1S/C12H12Cl2O4S/c1-18-11(15)4-7(12(16)17)6-19-8-2-3-9(13)10(14)5-8/h2-3,5,7H,4,6H2,1H3,(H,16,17)