[1,1,1-tris(fluoranyl)-3-oxidanylidene-3-phenyl-propan-2-yl] octanoate

Systemtic Name: [1,1,1-tris(fluoranyl)-3-oxidanylidene-3-phenyl-propan-2-yl] octanoate Openeye Name: (1-benzoyl-2,2,2-trifluoro-ethyl) octanoate CAS Name: octanoic acid (1,1,1-trifluoro-3-oxo-3-phenylpropan-2-yl) ester IUPAC Name: (1,1,1-trifluoro-3-oxo-3-phenylpropan-2-yl) octanoate Traditional Name: caprylic acid (1-benzoyl-2,2,2-trifluoro-ethyl) ester Formula: C17H21F3O3 MolecularWeight: 330.34205

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21F3O3/c1-2-3-4-5-9-12-14(21)23-16(17(18,19)20)15(22)13-10-7-6-8-11-13/h6-8,10-11,16H,2-5,9,12H2,1H3