pentadecyl 2,3,4-tris(fluoranyl)benzoate

Systemtic Name: pentadecyl 2,3,4-tris(fluoranyl)benzoate Openeye Name: pentadecyl 2,3,4-trifluorobenzoate CAS Name: 2,3,4-trifluorobenzoic acid pentadecyl ester IUPAC Name: pentadecyl 2,3,4-trifluorobenzoate Traditional Name: 2,3,4-trifluorobenzoic acid pentadecyl ester Formula: C22H33F3O2 MolecularWeight: 386.49143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC(=O)C1=C(C(=C(C=C1)F)F)F

Isomeric SMILES

CCCCCCCCCCCCCCCOC(=O)C1=C(C(=C(C=C1)F)F)F

InChI

InChI=1S/C22H33F3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-27-22(26)18-15-16-19(23)21(25)20(18)24/h15-16H,2-14,17H2,1H3