5-chloranyl-2-(3-methylphenyl)sulfanyl-benzoic acid

Systemtic Name: 5-chloranyl-2-(3-methylphenyl)sulfanyl-benzoic acid Openeye Name: 5-chloro-2-(m-tolylsulfanyl)benzoic acid CAS Name: 5-chloro-2-[(3-methylphenyl)thio]benzoic acid IUPAC Name: 5-chloro-2-(3-methylphenyl)sulfanylbenzoic acid Traditional Name: 5-chloro-2-(m-tolylthio)benzoic acid Formula: C14H11ClO2S MolecularWeight: 278.75394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=C(C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)SC2=C(C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C14H11ClO2S/c1-9-3-2-4-11(7-9)18-13-6-5-10(15)8-12(13)14(16)17/h2-8H,1H3,(H,16,17)