cyanomethyl 2,5-bis[2,2,2-tris(fluoranyl)ethoxy]benzoate

Systemtic Name: cyanomethyl 2,5-bis[2,2,2-tris(fluoranyl)ethoxy]benzoate Openeye Name: cyanomethyl 2,5-bis(2,2,2-trifluoroethoxy)benzoate CAS Name: 2,5-bis(2,2,2-trifluoroethoxy)benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2,5-bis(2,2,2-trifluoroethoxy)benzoate Traditional Name: 2,5-bis(2,2,2-trifluoroethoxy)benzoic acid cyanomethyl ester Formula: C13H9F6NO4 MolecularWeight: 357.205279

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OCC(F)(F)F)C(=O)OCC#N)OCC(F)(F)F

Isomeric SMILES

C1=CC(=C(C=C1OCC(F)(F)F)C(=O)OCC#N)OCC(F)(F)F

InChI

InChI=1S/C13H9F6NO4/c14-12(15,16)6-23-8-1-2-10(24-7-13(17,18)19)9(5-8)11(21)22-4-3-20/h1-2,5H,4,6-7H2