4-[2-[2,5-bis(chloranyl)phenyl]sulfonylethylsulfanylmethyl]benzoic acid

Systemtic Name: 4-[2-[2,5-bis(chloranyl)phenyl]sulfonylethylsulfanylmethyl]benzoic acid Openeye Name: 4-[2-(2,5-dichlorophenyl)sulfonylethylsulfanylmethyl]benzoic acid CAS Name: 4-[[2-(2,5-dichlorophenyl)sulfonylethylthio]methyl]benzoic acid IUPAC Name: 4-[2-(2,5-dichlorophenyl)sulfonylethylsulfanylmethyl]benzoic acid Traditional Name: 4-[[2-(2,5-dichlorophenyl)sulfonylethylthio]methyl]benzoic acid Formula: C16H14Cl2O4S2 MolecularWeight: 405.31596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCCS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CSCCS(=O)(=O)C2=C(C=CC(=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C16H14Cl2O4S2/c17-13-5-6-14(18)15(9-13)24(21,22)8-7-23-10-11-1-3-12(4-2-11)16(19)20/h1-6,9H,7-8,10H2,(H,19,20)