2,2,3,3-tetrakis(fluoranyl)propyl 4-(4-hexoxyphenyl)benzoate

Systemtic Name: 2,2,3,3-tetrakis(fluoranyl)propyl 4-(4-hexoxyphenyl)benzoate Openeye Name: 2,2,3,3-tetrafluoropropyl 4-(4-hexoxyphenyl)benzoate CAS Name: 4-(4-hexoxyphenyl)benzoic acid 2,2,3,3-tetrafluoropropyl ester IUPAC Name: 2,2,3,3-tetrafluoropropyl 4-(4-hexoxyphenyl)benzoate Traditional Name: 4-(4-hexoxyphenyl)benzoic acid 2,2,3,3-tetrafluoropropyl ester Formula: C22H24F4O3 MolecularWeight: 412.417773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(C(F)F)(F)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(C(F)F)(F)F

InChI

InChI=1S/C22H24F4O3/c1-2-3-4-5-14-28-19-12-10-17(11-13-19)16-6-8-18(9-7-16)20(27)29-15-22(25,26)21(23)24/h6-13,21H,2-5,14-15H2,1H3