[7-ethoxy-1,1,1-tris(fluoranyl)heptan-2-yl] 4-acetyloxy-2-fluoranyl-benzoate

Systemtic Name: [7-ethoxy-1,1,1-tris(fluoranyl)heptan-2-yl] 4-acetyloxy-2-fluoranyl-benzoate Openeye Name: [6-ethoxy-1-(trifluoromethyl)hexyl] 4-acetoxy-2-fluoro-benzoate CAS Name: 4-acetyloxy-2-fluorobenzoic acid (7-ethoxy-1,1,1-trifluoroheptan-2-yl) ester IUPAC Name: (7-ethoxy-1,1,1-trifluoroheptan-2-yl) 4-acetyloxy-2-fluorobenzoate Traditional Name: 4-acetoxy-2-fluoro-benzoic acid [6-ethoxy-1-(trifluoromethyl)hexyl] ester Formula: C18H22F4O5 MolecularWeight: 394.357893

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCCCC(C(F)(F)F)OC(=O)C1=C(C=C(C=C1)OC(=O)C)F

Isomeric SMILES

CCOCCCCCC(C(F)(F)F)OC(=O)C1=C(C=C(C=C1)OC(=O)C)F

InChI

InChI=1S/C18H22F4O5/c1-3-25-10-6-4-5-7-16(18(20,21)22)27-17(24)14-9-8-13(11-15(14)19)26-12(2)23/h8-9,11,16H,3-7,10H2,1-2H3