pentyl 2-[3-[3-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl]benzoate

Systemtic Name: pentyl 2-[3-[3-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl]benzoate Openeye Name: pentyl 2-[3-[3-(trifluoromethyl)phenyl]isoxazol-5-yl]benzoate CAS Name: 2-[3-[3-(trifluoromethyl)phenyl]-5-isoxazolyl]benzoic acid pentyl ester IUPAC Name: pentyl 2-[3-[3-(trifluoromethyl)phenyl]-1,2-oxazol-5-yl]benzoate Traditional Name: 2-[3-[3-(trifluoromethyl)phenyl]isoxazol-5-yl]benzoic acid amyl ester Formula: C22H20F3NO3 MolecularWeight: 403.39431

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=CC=C1C2=CC(=NO2)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCCCCOC(=O)C1=CC=CC=C1C2=CC(=NO2)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C22H20F3NO3/c1-2-3-6-12-28-21(27)18-11-5-4-10-17(18)20-14-19(26-29-20)15-8-7-9-16(13-15)22(23,24)25/h4-5,7-11,13-14H,2-3,6,12H2,1H3