(3-fluorophenyl) 4-cyano-2-ethyl-1,3-dioxane-5-carboxylate

Systemtic Name: (3-fluorophenyl) 4-cyano-2-ethyl-1,3-dioxane-5-carboxylate Openeye Name: (3-fluorophenyl) 4-cyano-2-ethyl-1,3-dioxane-5-carboxylate CAS Name: 4-cyano-2-ethyl-1,3-dioxane-5-carboxylic acid (3-fluorophenyl) ester IUPAC Name: (3-fluorophenyl) 4-cyano-2-ethyl-1,3-dioxane-5-carboxylate Traditional Name: 4-cyano-2-ethyl-1,3-dioxane-5-carboxylic acid (3-fluorophenyl) ester Formula: C14H14FNO4 MolecularWeight: 279.263663

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Descriptors Computed from Structure

Canonical SMILES:

CCC1OCC(C(O1)C#N)C(=O)OC2=CC(=CC=C2)F

Isomeric SMILES

CCC1OCC(C(O1)C#N)C(=O)OC2=CC(=CC=C2)F

InChI

InChI=1S/C14H14FNO4/c1-2-13-18-8-11(12(7-16)20-13)14(17)19-10-5-3-4-9(15)6-10/h3-6,11-13H,2,8H2,1H3