[1,1,1-tris(fluoranyl)-6-methyl-hept-5-en-2-yl] benzoate

Systemtic Name: [1,1,1-tris(fluoranyl)-6-methyl-hept-5-en-2-yl] benzoate Openeye Name: [5-methyl-1-(trifluoromethyl)hex-4-enyl] benzoate CAS Name: benzoic acid (1,1,1-trifluoro-6-methylhept-5-en-2-yl) ester IUPAC Name: (1,1,1-trifluoro-6-methylhept-5-en-2-yl) benzoate Traditional Name: benzoic acid [5-methyl-1-(trifluoromethyl)hex-4-enyl] ester Formula: C15H17F3O2 MolecularWeight: 286.28949

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17F3O2/c1-11(2)7-6-10-13(15(16,17)18)20-14(19)12-8-4-3-5-9-12/h3-5,7-9,13H,6,10H2,1-2H3