[1,1,1-tris(fluoranyl)-3-oxidanylidene-nonan-2-yl] benzoate

Systemtic Name: [1,1,1-tris(fluoranyl)-3-oxidanylidene-nonan-2-yl] benzoate Openeye Name: [2-oxo-1-(trifluoromethyl)octyl] benzoate CAS Name: benzoic acid (1,1,1-trifluoro-3-oxononan-2-yl) ester IUPAC Name: (1,1,1-trifluoro-3-oxononan-2-yl) benzoate Traditional Name: benzoic acid [2-keto-1-(trifluoromethyl)octyl] ester Formula: C16H19F3O3 MolecularWeight: 316.31547

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19F3O3/c1-2-3-4-8-11-13(20)14(16(17,18)19)22-15(21)12-9-6-5-7-10-12/h5-7,9-10,14H,2-4,8,11H2,1H3