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

Systemtic Name: oxolan-2-ylmethyl 2-[3,4-dicyano-2,5,6-tris(fluoranyl)phenoxy]-3-methyl-benzoate Openeye Name: tetrahydrofuran-2-ylmethyl 2-(3,4-dicyano-2,5,6-trifluoro-phenoxy)-3-methyl-benzoate CAS Name: 2-(3,4-dicyano-2,5,6-trifluorophenoxy)-3-methylbenzoic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 2-(3,4-dicyano-2,5,6-trifluorophenoxy)-3-methylbenzoate Traditional Name: 2-(3,4-dicyano-2,5,6-trifluoro-phenoxy)-3-methyl-benzoic acid tetrahydrofurfuryl ester Formula: C21H15F3N2O4 MolecularWeight: 416.35001

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC2=C(C(=C(C(=C2F)F)C#N)C#N)F)C(=O)OCC3CCCO3

Isomeric SMILES

CC1=CC=CC(=C1OC2=C(C(=C(C(=C2F)F)C#N)C#N)F)C(=O)OCC3CCCO3

InChI

InChI=1S/C21H15F3N2O4/c1-11-4-2-6-13(21(27)29-10-12-5-3-7-28-12)19(11)30-20-17(23)15(9-26)14(8-25)16(22)18(20)24/h2,4,6,12H,3,5,7,10H2,1H3