[3-(2,2-dimethylpropanoylamino)-4-phenyl-pyridin-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [3-(2,2-dimethylpropanoylamino)-4-phenyl-pyridin-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [3-(2,2-dimethylpropanoylamino)-4-phenyl-2-pyridyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [3-[(2,2-dimethyl-1-oxopropyl)amino]-4-phenyl-2-pyridinyl] ester IUPAC Name: [3-(2,2-dimethylpropanoylamino)-4-phenylpyridin-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-phenyl-3-(pivaloylamino)-2-pyridyl] ester Formula: C17H17F3N2O4S MolecularWeight: 402.38809

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=CN=C1OS(=O)(=O)C(F)(F)F)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=CN=C1OS(=O)(=O)C(F)(F)F)C2=CC=CC=C2

InChI

InChI=1S/C17H17F3N2O4S/c1-16(2,3)15(23)22-13-12(11-7-5-4-6-8-11)9-10-21-14(13)26-27(24,25)17(18,19)20/h4-10H,1-3H3,(H,22,23)