tert-butyl (E)-2-bromanyl-3-(trifluoromethyl)non-2-enoate

Systemtic Name: tert-butyl (E)-2-bromanyl-3-(trifluoromethyl)non-2-enoate Openeye Name: tert-butyl (E)-2-bromo-3-(trifluoromethyl)non-2-enoate CAS Name: (E)-2-bromo-3-(trifluoromethyl)-2-nonenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-2-bromo-3-(trifluoromethyl)non-2-enoate Traditional Name: (E)-2-bromo-3-(trifluoromethyl)non-2-enoic acid tert-butyl ester Formula: C14H22BrF3O2 MolecularWeight: 359.22249

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=C(C(=O)OC(C)(C)C)Br)C(F)(F)F

Isomeric SMILES

CCCCCC/C(=C(/C(=O)OC(C)(C)C)\Br)/C(F)(F)F

InChI

InChI=1S/C14H22BrF3O2/c1-5-6-7-8-9-10(14(16,17)18)11(15)12(19)20-13(2,3)4/h5-9H2,1-4H3/b11-10+