2-[3-(2,4-dichlorophenyl)propylsulfanylmethyl]-2-oxidanyl-butanedioic acid

Systemtic Name: 2-[3-(2,4-dichlorophenyl)propylsulfanylmethyl]-2-oxidanyl-butanedioic acid Openeye Name: 2-[3-(2,4-dichlorophenyl)propylsulfanylmethyl]-2-hydroxy-butanedioic acid CAS Name: 2-[[3-(2,4-dichlorophenyl)propylthio]methyl]-2-hydroxybutanedioic acid IUPAC Name: 2-[3-(2,4-dichlorophenyl)propylsulfanylmethyl]-2-hydroxybutanedioic acid Traditional Name: 2-[[3-(2,4-dichlorophenyl)propylthio]methyl]-2-hydroxy-succinic acid Formula: C14H16Cl2O5S MolecularWeight: 367.24484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CCCSCC(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CCCSCC(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C14H16Cl2O5S/c15-10-4-3-9(11(16)6-10)2-1-5-22-8-14(21,13(19)20)7-12(17)18/h3-4,6,21H,1-2,5,7-8H2,(H,17,18)(H,19,20)