2-[[4-(trifluoromethylsulfanyl)phenyl]amino]benzoic acid

Systemtic Name: 2-[[4-(trifluoromethylsulfanyl)phenyl]amino]benzoic acid Openeye Name: 2-[4-(trifluoromethylsulfanyl)anilino]benzoic acid CAS Name: 2-[4-(trifluoromethylthio)anilino]benzoic acid IUPAC Name: 2-[4-(trifluoromethylsulfanyl)anilino]benzoic acid Traditional Name: 2-[4-(trifluoromethylthio)anilino]benzoic acid Formula: C14H10F3NO2S MolecularWeight: 313.29491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)SC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=CC=C(C=C2)SC(F)(F)F

InChI

InChI=1S/C14H10F3NO2S/c15-14(16,17)21-10-7-5-9(6-8-10)18-12-4-2-1-3-11(12)13(19)20/h1-8,18H,(H,19,20)