4-[2-(4-chlorophenyl)sulfanylethoxy]benzoic acid

Systemtic Name: 4-[2-(4-chlorophenyl)sulfanylethoxy]benzoic acid Openeye Name: 4-[2-(4-chlorophenyl)sulfanylethoxy]benzoic acid CAS Name: 4-[2-[(4-chlorophenyl)thio]ethoxy]benzoic acid IUPAC Name: 4-[2-(4-chlorophenyl)sulfanylethoxy]benzoic acid Traditional Name: 4-[2-[(4-chlorophenyl)thio]ethoxy]benzoic acid Formula: C15H13ClO3S MolecularWeight: 308.77992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)OCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)OCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H13ClO3S/c16-12-3-7-14(8-4-12)20-10-9-19-13-5-1-11(2-6-13)15(17)18/h1-8H,9-10H2,(H,17,18)