2-propylsulfanyl-4-(trifluoromethyl)benzoic acid

Systemtic Name: 2-propylsulfanyl-4-(trifluoromethyl)benzoic acid Openeye Name: 2-propylsulfanyl-4-(trifluoromethyl)benzoic acid CAS Name: 2-(propylthio)-4-(trifluoromethyl)benzoic acid IUPAC Name: 2-propylsulfanyl-4-(trifluoromethyl)benzoic acid Traditional Name: 2-(propylthio)-4-(trifluoromethyl)benzoic acid Formula: C11H11F3O2S MolecularWeight: 264.26405

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC(=C1)C(F)(F)F)C(=O)O

Isomeric SMILES

CCCSC1=C(C=CC(=C1)C(F)(F)F)C(=O)O

InChI

InChI=1S/C11H11F3O2S/c1-2-5-17-9-6-7(11(12,13)14)3-4-8(9)10(15)16/h3-4,6H,2,5H2,1H3,(H,15,16)