(2,6-dimethyl-3-nitro-phenyl)methyl tris(fluoranyl)methanesulfonate

Systemtic Name: (2,6-dimethyl-3-nitro-phenyl)methyl tris(fluoranyl)methanesulfonate Openeye Name: (2,6-dimethyl-3-nitro-phenyl)methyl trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2,6-dimethyl-3-nitrophenyl)methyl ester IUPAC Name: (2,6-dimethyl-3-nitrophenyl)methyl trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2,6-dimethyl-3-nitro-benzyl) ester Formula: C10H10F3NO5S MolecularWeight: 313.25031

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])C)COS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])C)COS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C10H10F3NO5S/c1-6-3-4-9(14(15)16)7(2)8(6)5-19-20(17,18)10(11,12)13/h3-4H,5H2,1-2H3