2-[2-(4-methylphenyl)sulfanylethylsulfanyl]benzoic acid

Systemtic Name: 2-[2-(4-methylphenyl)sulfanylethylsulfanyl]benzoic acid Openeye Name: 2-[2-(p-tolylsulfanyl)ethylsulfanyl]benzoic acid CAS Name: 2-[2-[(4-methylphenyl)thio]ethylthio]benzoic acid IUPAC Name: 2-[2-(4-methylphenyl)sulfanylethylsulfanyl]benzoic acid Traditional Name: 2-[2-(p-tolylthio)ethylthio]benzoic acid Formula: C16H16O2S2 MolecularWeight: 304.42704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCSC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)SCCSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C16H16O2S2/c1-12-6-8-13(9-7-12)19-10-11-20-15-5-3-2-4-14(15)16(17)18/h2-9H,10-11H2,1H3,(H,17,18)