3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]propanoic acid

Systemtic Name: 3-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]propanoic acid Openeye Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]propanoic acid CAS Name: 3-[(2,6-dichlorophenyl)methylthio]propanoic acid IUPAC Name: 3-[(2,6-dichlorophenyl)methylsulfanyl]propanoic acid Traditional Name: 3-[(2,6-dichlorobenzyl)thio]propionic acid Formula: C10H10Cl2O2S MolecularWeight: 265.1562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10Cl2O2S/c11-8-2-1-3-9(12)7(8)6-15-5-4-10(13)14/h1-3H,4-6H2,(H,13,14)