(2-chloranyl-6-methyl-4-nitro-phenyl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2-chloranyl-6-methyl-4-nitro-phenyl) tris(fluoranyl)methanesulfonate Openeye Name: (2-chloro-6-methyl-4-nitro-phenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2-chloro-6-methyl-4-nitrophenyl) ester IUPAC Name: (2-chloro-6-methyl-4-nitrophenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2-chloro-6-methyl-4-nitro-phenyl) ester Formula: C8H5ClF3NO5S MolecularWeight: 319.64221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OS(=O)(=O)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OS(=O)(=O)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C8H5ClF3NO5S/c1-4-2-5(13(14)15)3-6(9)7(4)18-19(16,17)8(10,11)12/h2-3H,1H3