[4-(2-fluoranyl-4-propyl-phenyl)phenyl] 2-pentyl-1,3-dioxane-5-carboxylate

Systemtic Name: [4-(2-fluoranyl-4-propyl-phenyl)phenyl] 2-pentyl-1,3-dioxane-5-carboxylate Openeye Name: [4-(2-fluoro-4-propyl-phenyl)phenyl] 2-pentyl-1,3-dioxane-5-carboxylate CAS Name: 2-pentyl-1,3-dioxane-5-carboxylic acid [4-(2-fluoro-4-propylphenyl)phenyl] ester IUPAC Name: [4-(2-fluoro-4-propylphenyl)phenyl] 2-pentyl-1,3-dioxane-5-carboxylate Traditional Name: 2-amyl-1,3-dioxane-5-carboxylic acid [4-(2-fluoro-4-propyl-phenyl)phenyl] ester Formula: C25H31FO4 MolecularWeight: 414.509643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1OCC(CO1)C(=O)OC2=CC=C(C=C2)C3=C(C=C(C=C3)CCC)F

Isomeric SMILES

CCCCCC1OCC(CO1)C(=O)OC2=CC=C(C=C2)C3=C(C=C(C=C3)CCC)F

InChI

InChI=1S/C25H31FO4/c1-3-5-6-8-24-28-16-20(17-29-24)25(27)30-21-12-10-19(11-13-21)22-14-9-18(7-4-2)15-23(22)26/h9-15,20,24H,3-8,16-17H2,1-2H3