2-[3,5-bis(chloranyl)phenyl]sulfanylethanoic acid

Systemtic Name: 2-[3,5-bis(chloranyl)phenyl]sulfanylethanoic acid Openeye Name: 2-(3,5-dichlorophenyl)sulfanylacetic acid CAS Name: 2-[(3,5-dichlorophenyl)thio]acetic acid IUPAC Name: 2-(3,5-dichlorophenyl)sulfanylacetic acid Traditional Name: 2-[(3,5-dichlorophenyl)thio]acetic acid Formula: C8H6Cl2O2S MolecularWeight: 237.10304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1Cl)Cl)SCC(=O)O

Isomeric SMILES

C1=C(C=C(C=C1Cl)Cl)SCC(=O)O

InChI

InChI=1S/C8H6Cl2O2S/c9-5-1-6(10)3-7(2-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)