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

Systemtic Name: 2-(3-methylphenyl)sulfanyl-5-(trifluoromethyl)benzoic acid Openeye Name: 2-(m-tolylsulfanyl)-5-(trifluoromethyl)benzoic acid CAS Name: 2-[(3-methylphenyl)thio]-5-(trifluoromethyl)benzoic acid IUPAC Name: 2-(3-methylphenyl)sulfanyl-5-(trifluoromethyl)benzoic acid Traditional Name: 2-(m-tolylthio)-5-(trifluoromethyl)benzoic acid Formula: C15H11F3O2S MolecularWeight: 312.30685

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11F3O2S/c1-9-3-2-4-11(7-9)21-13-6-5-10(15(16,17)18)8-12(13)14(19)20/h2-8H,1H3,(H,19,20)