phenyl 3,4,5-tris(fluoranyl)-2-(2-fluoranylpropyl)benzoate

Systemtic Name: phenyl 3,4,5-tris(fluoranyl)-2-(2-fluoranylpropyl)benzoate Openeye Name: phenyl 3,4,5-trifluoro-2-(2-fluoropropyl)benzoate CAS Name: 3,4,5-trifluoro-2-(2-fluoropropyl)benzoic acid phenyl ester IUPAC Name: phenyl 3,4,5-trifluoro-2-(2-fluoropropyl)benzoate Traditional Name: 3,4,5-trifluoro-2-(2-fluoropropyl)benzoic acid phenyl ester Formula: C16H12F4O2 MolecularWeight: 312.258893

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C(C(=C(C=C1C(=O)OC2=CC=CC=C2)F)F)F)F

Isomeric SMILES

CC(CC1=C(C(=C(C=C1C(=O)OC2=CC=CC=C2)F)F)F)F

InChI

InChI=1S/C16H12F4O2/c1-9(17)7-11-12(8-13(18)15(20)14(11)19)16(21)22-10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3