tert-butyl (E)-4-methyl-2-(3-phenylpropyl)-3-(trifluoromethylsulfonyloxy)pent-2-enoate

Systemtic Name: tert-butyl (E)-4-methyl-2-(3-phenylpropyl)-3-(trifluoromethylsulfonyloxy)pent-2-enoate Openeye Name: tert-butyl (E)-4-methyl-2-(3-phenylpropyl)-3-(trifluoromethylsulfonyloxy)pent-2-enoate CAS Name: (E)-4-methyl-2-(3-phenylpropyl)-3-(trifluoromethylsulfonyloxy)-2-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-4-methyl-2-(3-phenylpropyl)-3-(trifluoromethylsulfonyloxy)pent-2-enoate Traditional Name: (E)-4-methyl-2-(3-phenylpropyl)-3-triflyloxy-pent-2-enoic acid tert-butyl ester Formula: C20H27F3O5S MolecularWeight: 436.48559

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=C(CCCC1=CC=CC=C1)C(=O)OC(C)(C)C)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)/C(=C(/CCCC1=CC=CC=C1)\C(=O)OC(C)(C)C)/OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C20H27F3O5S/c1-14(2)17(28-29(25,26)20(21,22)23)16(18(24)27-19(3,4)5)13-9-12-15-10-7-6-8-11-15/h6-8,10-11,14H,9,12-13H2,1-5H3/b17-16+