[(E)-3-phenylprop-2-enyl] 2,2,3,3,4,4,4-heptakis(fluoranyl)butanoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 2,2,3,3,4,4,4-heptakis(fluoranyl)butanoate Openeye Name: [(E)-cinnamyl] 2,2,3,3,4,4,4-heptafluorobutanoate CAS Name: 2,2,3,3,4,4,4-heptafluorobutanoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 2,2,3,3,4,4,4-heptafluorobutanoate Traditional Name: 2,2,3,3,4,4,4-heptafluorobutyric acid [(E)-cinnamyl] ester Formula: C13H9F7O2 MolecularWeight: 330.198182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCOC(=O)C(C(C(F)(F)F)(F)F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)/C=C/COC(=O)C(C(C(F)(F)F)(F)F)(F)F

InChI

InChI=1S/C13H9F7O2/c14-11(15,12(16,17)13(18,19)20)10(21)22-8-4-7-9-5-2-1-3-6-9/h1-7H,8H2/b7-4+