(phenylmethyl) 4-tert-butyl-6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-tert-butyl-6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate Openeye Name: benzyl 4-tert-butyl-6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate CAS Name: 4-tert-butyl-6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-tert-butyl-6-(trifluoromethylsulfonyloxy)-3,4-dihydro-2H-pyridine-1-carboxylate Traditional Name: 4-tert-butyl-6-triflyloxy-3,4-dihydro-2H-pyridine-1-carboxylic acid benzyl ester Formula: C18H22F3NO5S MolecularWeight: 421.43119

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCN(C(=C1)OS(=O)(=O)C(F)(F)F)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1CCN(C(=C1)OS(=O)(=O)C(F)(F)F)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22F3NO5S/c1-17(2,3)14-9-10-22(15(11-14)27-28(24,25)18(19,20)21)16(23)26-12-13-7-5-4-6-8-13/h4-8,11,14H,9-10,12H2,1-3H3