3-(2,4-dichlorophenyl)propanethioic S-acid

Systemtic Name: 3-(2,4-dichlorophenyl)propanethioic S-acid Openeye Name: 3-(2,4-dichlorophenyl)propanethioic S-acid CAS Name: 3-(2,4-dichlorophenyl)propanethioic S-acid IUPAC Name: 3-(2,4-dichlorophenyl)propanethioic S-acid Traditional Name: 3-(2,4-dichlorophenyl)thiopropionic acid Formula: C9H8Cl2OS MolecularWeight: 235.13022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CCC(=O)S

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CCC(=O)S

InChI

InChI=1S/C9H8Cl2OS/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1,3,5H,2,4H2,(H,12,13)