[(E,1S)-1-cyclohexyl-4,4,4-tris(fluoranyl)but-2-enyl] 2-methoxyethanoate

Systemtic Name: [(E,1S)-1-cyclohexyl-4,4,4-tris(fluoranyl)but-2-enyl] 2-methoxyethanoate Openeye Name: [(E,1S)-1-cyclohexyl-4,4,4-trifluoro-but-2-enyl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [(E,1S)-1-cyclohexyl-4,4,4-trifluorobut-2-enyl] ester IUPAC Name: [(E,1S)-1-cyclohexyl-4,4,4-trifluorobut-2-enyl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [(E,1S)-1-cyclohexyl-4,4,4-trifluoro-but-2-enyl] ester Formula: C13H19F3O3 MolecularWeight: 280.28337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)OC(C=CC(F)(F)F)C1CCCCC1

Isomeric SMILES

COCC(=O)O[C@H](/C=C/C(F)(F)F)C1CCCCC1

InChI

InChI=1S/C13H19F3O3/c1-18-9-12(17)19-11(7-8-13(14,15)16)10-5-3-2-4-6-10/h7-8,10-11H,2-6,9H2,1H3/b8-7+/t11-/m1/s1