pentyl 4-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate

Systemtic Name: pentyl 4-[2,2,2-tris(fluoranyl)ethanoylamino]benzoate Openeye Name: pentyl 4-[(2,2,2-trifluoroacetyl)amino]benzoate CAS Name: 4-[(2,2,2-trifluoro-1-oxoethyl)amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(2,2,2-trifluoroacetyl)amino]benzoate Traditional Name: 4-[(2,2,2-trifluoroacetyl)amino]benzoic acid amyl ester Formula: C14H16F3NO3 MolecularWeight: 303.27695

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(F)(F)F

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(F)(F)F

InChI

InChI=1S/C14H16F3NO3/c1-2-3-4-9-21-12(19)10-5-7-11(8-6-10)18-13(20)14(15,16)17/h5-8H,2-4,9H2,1H3,(H,18,20)