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

Systemtic Name: (3-methoxy-2-methyl-6-nitro-phenyl) tris(fluoranyl)methanesulfonate Openeye Name: (3-methoxy-2-methyl-6-nitro-phenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (3-methoxy-2-methyl-6-nitrophenyl) ester IUPAC Name: (3-methoxy-2-methyl-6-nitrophenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (3-methoxy-2-methyl-6-nitro-phenyl) ester Formula: C9H8F3NO6S MolecularWeight: 315.22313

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8F3NO6S/c1-5-7(18-2)4-3-6(13(14)15)8(5)19-20(16,17)9(10,11)12/h3-4H,1-2H3