2-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]sulfanylbenzoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[[3-(trifluoromethyl)phenyl]amino]ethyl]sulfanylbenzoic acid Openeye Name: 2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanylbenzoic acid CAS Name: 2-[[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]thio]benzoic acid IUPAC Name: 2-[2-oxo-2-[3-(trifluoromethyl)anilino]ethyl]sulfanylbenzoic acid Traditional Name: 2-[[2-keto-2-[3-(trifluoromethyl)anilino]ethyl]thio]benzoic acid Formula: C16H12F3NO3S MolecularWeight: 355.33159

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12F3NO3S/c17-16(18,19)10-4-3-5-11(8-10)20-14(21)9-24-13-7-2-1-6-12(13)15(22)23/h1-8H,9H2,(H,20,21)(H,22,23)