2-[[2-(trifluoromethylsulfanyl)phenyl]amino]ethanoic acid

Systemtic Name: 2-[[2-(trifluoromethylsulfanyl)phenyl]amino]ethanoic acid Openeye Name: 2-[2-(trifluoromethylsulfanyl)anilino]acetic acid CAS Name: 2-[2-(trifluoromethylthio)anilino]acetic acid IUPAC Name: 2-[2-(trifluoromethylsulfanyl)anilino]acetic acid Traditional Name: 2-[2-(trifluoromethylthio)anilino]acetic acid Formula: C9H8F3NO2S MolecularWeight: 251.22553

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NCC(=O)O)SC(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)NCC(=O)O)SC(F)(F)F

InChI

InChI=1S/C9H8F3NO2S/c10-9(11,12)16-7-4-2-1-3-6(7)13-5-8(14)15/h1-4,13H,5H2,(H,14,15)