4-(3,4-dichlorophenyl)-2-(2-hydroxyethylsulfanyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(3,4-dichlorophenyl)-2-(2-hydroxyethylsulfanyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,4-dichlorophenyl)-2-(2-hydroxyethylsulfanyl)-4-oxo-butanoic acid CAS Name: 4-(3,4-dichlorophenyl)-2-(2-hydroxyethylthio)-4-oxobutanoic acid IUPAC Name: 4-(3,4-dichlorophenyl)-2-(2-hydroxyethylsulfanyl)-4-oxobutanoic acid Traditional Name: 4-(3,4-dichlorophenyl)-2-(2-hydroxyethylthio)-4-keto-butyric acid Formula: C12H12Cl2O4S MolecularWeight: 323.19228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CC(C(=O)O)SCCO)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CC(C(=O)O)SCCO)Cl)Cl

InChI

InChI=1S/C12H12Cl2O4S/c13-8-2-1-7(5-9(8)14)10(16)6-11(12(17)18)19-4-3-15/h1-2,5,11,15H,3-4,6H2,(H,17,18)