3-[(4-chlorophenyl)methylsulfanyl]propanoic acid

Systemtic Name: 3-[(4-chlorophenyl)methylsulfanyl]propanoic acid Openeye Name: 3-[(4-chlorophenyl)methylsulfanyl]propanoic acid CAS Name: 3-[(4-chlorophenyl)methylthio]propanoic acid IUPAC Name: 3-[(4-chlorophenyl)methylsulfanyl]propanoic acid Traditional Name: 3-[(4-chlorobenzyl)thio]propionic acid Formula: C10H11ClO2S MolecularWeight: 230.71114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CSCCC(=O)O)Cl

InChI

InChI=1S/C10H11ClO2S/c11-9-3-1-8(2-4-9)7-14-6-5-10(12)13/h1-4H,5-7H2,(H,12,13)