[2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-[[4-(trifluoromethyloxy)phenyl]amino]ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-keto-2-[4-(trifluoromethoxy)anilino]ethyl] ester Formula: C18H16F3NO4S MolecularWeight: 399.38415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)SCCC(=O)OCC(=O)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C18H16F3NO4S/c19-18(20,21)26-14-8-6-13(7-9-14)22-16(23)12-25-17(24)10-11-27-15-4-2-1-3-5-15/h1-9H,10-12H2,(H,22,23)