(4-cyanophenyl) 2-chloranyl-3,5,6-tris(fluoranyl)-4-(pentoxymethyl)benzoate

Systemtic Name: (4-cyanophenyl) 2-chloranyl-3,5,6-tris(fluoranyl)-4-(pentoxymethyl)benzoate Openeye Name: (4-cyanophenyl) 2-chloro-3,5,6-trifluoro-4-(pentoxymethyl)benzoate CAS Name: 2-chloro-3,5,6-trifluoro-4-(pentoxymethyl)benzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 2-chloro-3,5,6-trifluoro-4-(pentoxymethyl)benzoate Traditional Name: 4-(amoxymethyl)-2-chloro-3,5,6-trifluoro-benzoic acid (4-cyanophenyl) ester Formula: C20H17ClF3NO3 MolecularWeight: 411.80209

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOCC1=C(C(=C(C(=C1F)Cl)C(=O)OC2=CC=C(C=C2)C#N)F)F

Isomeric SMILES

CCCCCOCC1=C(C(=C(C(=C1F)Cl)C(=O)OC2=CC=C(C=C2)C#N)F)F

InChI

InChI=1S/C20H17ClF3NO3/c1-2-3-4-9-27-11-14-17(22)16(21)15(19(24)18(14)23)20(26)28-13-7-5-12(10-25)6-8-13/h5-8H,2-4,9,11H2,1H3