(2,2,4-trimethyl-1H-quinolin-6-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2,2,4-trimethyl-1H-quinolin-6-yl) tris(fluoranyl)methanesulfonate Openeye Name: (2,2,4-trimethyl-1H-quinolin-6-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester IUPAC Name: (2,2,4-trimethyl-1H-quinolin-6-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2,2,4-trimethyl-1H-quinolin-6-yl) ester Formula: C13H14F3NO3S MolecularWeight: 321.31537

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(NC2=C1C=C(C=C2)OS(=O)(=O)C(F)(F)F)(C)C

Isomeric SMILES

CC1=CC(NC2=C1C=C(C=C2)OS(=O)(=O)C(F)(F)F)(C)C

InChI

InChI=1S/C13H14F3NO3S/c1-8-7-12(2,3)17-11-5-4-9(6-10(8)11)20-21(18,19)13(14,15)16/h4-7,17H,1-3H3