propyl 4-[3,3,3-tris(fluoranyl)propanoylamino]benzoate

Systemtic Name: propyl 4-[3,3,3-tris(fluoranyl)propanoylamino]benzoate Openeye Name: propyl 4-(3,3,3-trifluoropropanoylamino)benzoate CAS Name: 4-[(3,3,3-trifluoro-1-oxopropyl)amino]benzoic acid propyl ester IUPAC Name: propyl 4-(3,3,3-trifluoropropanoylamino)benzoate Traditional Name: 4-(3,3,3-trifluoropropanoylamino)benzoic acid propyl ester Formula: C13H14F3NO3 MolecularWeight: 289.25037

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14F3NO3/c1-2-7-20-12(19)9-3-5-10(6-4-9)17-11(18)8-13(14,15)16/h3-6H,2,7-8H2,1H3,(H,17,18)