4-[(3-chlorophenyl)sulfanylmethyl]benzoic acid

Systemtic Name: 4-[(3-chlorophenyl)sulfanylmethyl]benzoic acid Openeye Name: 4-[(3-chlorophenyl)sulfanylmethyl]benzoic acid CAS Name: 4-[[(3-chlorophenyl)thio]methyl]benzoic acid IUPAC Name: 4-[(3-chlorophenyl)sulfanylmethyl]benzoic acid Traditional Name: 4-[[(3-chlorophenyl)thio]methyl]benzoic acid Formula: C14H11ClO2S MolecularWeight: 278.75394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)SCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)SCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H11ClO2S/c15-12-2-1-3-13(8-12)18-9-10-4-6-11(7-5-10)14(16)17/h1-8H,9H2,(H,16,17)