1-[4-[3,4-bis(fluoranyl)phenyl]sulfanyl-3-nitro-phenyl]sulfonylpyrrolidine

Systemtic Name: 1-[4-[3,4-bis(fluoranyl)phenyl]sulfanyl-3-nitro-phenyl]sulfonylpyrrolidine Openeye Name: 1-[4-(3,4-difluorophenyl)sulfanyl-3-nitro-phenyl]sulfonylpyrrolidine CAS Name: 1-[4-[(3,4-difluorophenyl)thio]-3-nitrophenyl]sulfonylpyrrolidine IUPAC Name: 1-[4-(3,4-difluorophenyl)sulfanyl-3-nitrophenyl]sulfonylpyrrolidine Traditional Name: 1-[4-[(3,4-difluorophenyl)thio]-3-nitro-phenyl]sulfonylpyrrolidine Formula: C16H14F2N2O4S2 MolecularWeight: 400.420166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC(=C(C=C3)F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)SC3=CC(=C(C=C3)F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H14F2N2O4S2/c17-13-5-3-11(9-14(13)18)25-16-6-4-12(10-15(16)20(21)22)26(23,24)19-7-1-2-8-19/h3-6,9-10H,1-2,7-8H2