ethyl 4-[16,16,16-tris(fluoranyl)hexadecanoylamino]benzoate

Systemtic Name: ethyl 4-[16,16,16-tris(fluoranyl)hexadecanoylamino]benzoate Openeye Name: ethyl 4-(16,16,16-trifluorohexadecanoylamino)benzoate CAS Name: 4-[(16,16,16-trifluoro-1-oxohexadecyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(16,16,16-trifluorohexadecanoylamino)benzoate Traditional Name: 4-(16,16,16-trifluorohexadecanoylamino)benzoic acid ethyl ester Formula: C25H38F3NO3 MolecularWeight: 457.56933

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H38F3NO3/c1-2-32-24(31)21-16-18-22(19-17-21)29-23(30)15-13-11-9-7-5-3-4-6-8-10-12-14-20-25(26,27)28/h16-19H,2-15,20H2,1H3,(H,29,30)