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

Systemtic Name: 1-methoxyethyl 2-[3,4-dicyano-2,5,6-tris(fluoranyl)phenoxy]-3-ethoxy-benzoate Openeye Name: 1-methoxyethyl 2-(3,4-dicyano-2,5,6-trifluoro-phenoxy)-3-ethoxy-benzoate CAS Name: 2-(3,4-dicyano-2,5,6-trifluorophenoxy)-3-ethoxybenzoic acid 1-methoxyethyl ester IUPAC Name: 1-methoxyethyl 2-(3,4-dicyano-2,5,6-trifluorophenoxy)-3-ethoxybenzoate Traditional Name: 2-(3,4-dicyano-2,5,6-trifluoro-phenoxy)-3-ethoxy-benzoic acid 1-methoxyethyl ester Formula: C20H15F3N2O5 MolecularWeight: 420.33871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OC2=C(C(=C(C(=C2F)F)C#N)C#N)F)C(=O)OC(C)OC

Isomeric SMILES

CCOC1=CC=CC(=C1OC2=C(C(=C(C(=C2F)F)C#N)C#N)F)C(=O)OC(C)OC

InChI

InChI=1S/C20H15F3N2O5/c1-4-28-14-7-5-6-11(20(26)29-10(2)27-3)18(14)30-19-16(22)13(9-25)12(8-24)15(21)17(19)23/h5-7,10H,4H2,1-3H3