2-[(3,4-dichlorophenyl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]propanoic acid Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]propanoic acid CAS Name: 2-[(3,4-dichlorophenyl)methylthio]propanoic acid IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]propanoic acid Traditional Name: 2-[(3,4-dichlorobenzyl)thio]propionic acid Formula: C10H10Cl2O2S MolecularWeight: 265.1562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C(=O)O)SCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C10H10Cl2O2S/c1-6(10(13)14)15-5-7-2-3-8(11)9(12)4-7/h2-4,6H,5H2,1H3,(H,13,14)