butyl 4-[3,4-dicyano-2,5,6-tris(fluoranyl)phenoxy]benzoate

Systemtic Name: butyl 4-[3,4-dicyano-2,5,6-tris(fluoranyl)phenoxy]benzoate Openeye Name: butyl 4-(3,4-dicyano-2,5,6-trifluoro-phenoxy)benzoate CAS Name: 4-(3,4-dicyano-2,5,6-trifluorophenoxy)benzoic acid butyl ester IUPAC Name: butyl 4-(3,4-dicyano-2,5,6-trifluorophenoxy)benzoate Traditional Name: 4-(3,4-dicyano-2,5,6-trifluoro-phenoxy)benzoic acid butyl ester Formula: C19H13F3N2O3 MolecularWeight: 374.31333

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OC2=C(C(=C(C(=C2F)F)C#N)C#N)F

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OC2=C(C(=C(C(=C2F)F)C#N)C#N)F

InChI

InChI=1S/C19H13F3N2O3/c1-2-3-8-26-19(25)11-4-6-12(7-5-11)27-18-16(21)14(10-24)13(9-23)15(20)17(18)22/h4-7H,2-3,8H2,1H3