3-(3,4-dichlorophenyl)-3-oxidanyl-propanethioate

Systemtic Name: 3-(3,4-dichlorophenyl)-3-oxidanyl-propanethioate Openeye Name: 3-(3,4-dichlorophenyl)-3-hydroxy-propanethioate CAS Name: 3-(3,4-dichlorophenyl)-3-hydroxypropanethioate IUPAC Name: 3-(3,4-dichlorophenyl)-3-hydroxypropanethioate Traditional Name: 3-(3,4-dichlorophenyl)-3-hydroxy-thiopropionate Formula: C9H7Cl2O2S- MolecularWeight: 250.12168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(CC(=S)[O-])O)Cl)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(CC(=S)[O-])O)Cl)Cl

InChI

InChI=1S/C9H8Cl2O2S/c10-6-2-1-5(3-7(6)11)8(12)4-9(13)14/h1-3,8,12H,4H2,(H,13,14)/p-1