[2-(2-nitroethyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(2-nitroethyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-(2-nitroethyl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(2-nitroethyl)phenyl] ester IUPAC Name: [2-(2-nitroethyl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(2-nitroethyl)phenyl] ester Formula: C9H8F3NO5S MolecularWeight: 299.22373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC[N+](=O)[O-])OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CC[N+](=O)[O-])OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H8F3NO5S/c10-9(11,12)19(16,17)18-8-4-2-1-3-7(8)5-6-13(14)15/h1-4H,5-6H2