4-[(2,4-dichlorophenyl)methylsulfanyl]benzoic acid

Systemtic Name: 4-[(2,4-dichlorophenyl)methylsulfanyl]benzoic acid Openeye Name: 4-[(2,4-dichlorophenyl)methylsulfanyl]benzoic acid CAS Name: 4-[(2,4-dichlorophenyl)methylthio]benzoic acid IUPAC Name: 4-[(2,4-dichlorophenyl)methylsulfanyl]benzoic acid Traditional Name: 4-[(2,4-dichlorobenzyl)thio]benzoic acid Formula: C14H10Cl2O2S MolecularWeight: 313.199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)SCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)SCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C14H10Cl2O2S/c15-11-4-1-10(13(16)7-11)8-19-12-5-2-9(3-6-12)14(17)18/h1-7H,8H2,(H,17,18)