(4-cyanophenyl) 4-hexyl-2-phenyl-1,3-dioxane-5-carboxylate

Systemtic Name: (4-cyanophenyl) 4-hexyl-2-phenyl-1,3-dioxane-5-carboxylate Openeye Name: (4-cyanophenyl) 4-hexyl-2-phenyl-1,3-dioxane-5-carboxylate CAS Name: 4-hexyl-2-phenyl-1,3-dioxane-5-carboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-hexyl-2-phenyl-1,3-dioxane-5-carboxylate Traditional Name: 4-hexyl-2-phenyl-1,3-dioxane-5-carboxylic acid (4-cyanophenyl) ester Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(COC(O1)C2=CC=CC=C2)C(=O)OC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCC1C(COC(O1)C2=CC=CC=C2)C(=O)OC3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H27NO4/c1-2-3-4-8-11-22-21(17-27-24(29-22)19-9-6-5-7-10-19)23(26)28-20-14-12-18(16-25)13-15-20/h5-7,9-10,12-15,21-22,24H,2-4,8,11,17H2,1H3