(2,3-dimethyl-4-nitro-phenyl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2,3-dimethyl-4-nitro-phenyl) tris(fluoranyl)methanesulfonate Openeye Name: (2,3-dimethyl-4-nitro-phenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2,3-dimethyl-4-nitrophenyl) ester IUPAC Name: (2,3-dimethyl-4-nitrophenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2,3-dimethyl-4-nitro-phenyl) ester Formula: C9H8F3NO5S MolecularWeight: 299.22373

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1C)OS(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C9H8F3NO5S/c1-5-6(2)8(4-3-7(5)13(14)15)18-19(16,17)9(10,11)12/h3-4H,1-2H3