1-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylpyrrolidine Openeye Name: 1-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylpyrrolidine CAS Name: 1-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylpyrrolidine IUPAC Name: 1-[3-nitro-4-[[3-(trifluoromethyl)phenyl]methoxy]phenyl]sulfonylpyrrolidine Traditional Name: 1-[3-nitro-4-[3-(trifluoromethyl)benzyl]oxy-phenyl]sulfonylpyrrolidine Formula: C18H17F3N2O5S MolecularWeight: 430.39819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OCC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H17F3N2O5S/c19-18(20,21)14-5-3-4-13(10-14)12-28-17-7-6-15(11-16(17)23(24)25)29(26,27)22-8-1-2-9-22/h3-7,10-11H,1-2,8-9,12H2