[4-ethoxy-1,1,1-tris(fluoranyl)-3-methyl-4-oxidanylidene-butan-2-yl] 4-methylbenzoate

Systemtic Name: [4-ethoxy-1,1,1-tris(fluoranyl)-3-methyl-4-oxidanylidene-butan-2-yl] 4-methylbenzoate Openeye Name: [3-ethoxy-2-methyl-3-oxo-1-(trifluoromethyl)propyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid (4-ethoxy-1,1,1-trifluoro-3-methyl-4-oxobutan-2-yl) ester IUPAC Name: (4-ethoxy-1,1,1-trifluoro-3-methyl-4-oxobutan-2-yl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [3-ethoxy-3-keto-2-methyl-1-(trifluoromethyl)propyl] ester Formula: C15H17F3O4 MolecularWeight: 318.28829

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C(C(F)(F)F)OC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCOC(=O)C(C)C(C(F)(F)F)OC(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C15H17F3O4/c1-4-21-13(19)10(3)12(15(16,17)18)22-14(20)11-7-5-9(2)6-8-11/h5-8,10,12H,4H2,1-3H3