methyl 4-[4-[2,2,2-tris(fluoranyl)ethanoylamino]phenyl]butanoate

Systemtic Name: methyl 4-[4-[2,2,2-tris(fluoranyl)ethanoylamino]phenyl]butanoate Openeye Name: methyl 4-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]butanoate CAS Name: 4-[4-[(2,2,2-trifluoro-1-oxoethyl)amino]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]butanoate Traditional Name: 4-[4-[(2,2,2-trifluoroacetyl)amino]phenyl]butyric acid methyl ester Formula: C13H14F3NO3 MolecularWeight: 289.25037

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC=C(C=C1)NC(=O)C(F)(F)F

Isomeric SMILES

COC(=O)CCCC1=CC=C(C=C1)NC(=O)C(F)(F)F

InChI

InChI=1S/C13H14F3NO3/c1-20-11(18)4-2-3-9-5-7-10(8-6-9)17-12(19)13(14,15)16/h5-8H,2-4H2,1H3,(H,17,19)