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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(OCC(CO1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCC)F

Isomeric SMILES

CCCCCC1(OCC(CO1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)CCC)F

InChI

InChI=1S/C25H31FO4/c1-3-5-6-16-25(26)28-17-22(18-29-25)24(27)30-23-14-12-21(13-15-23)20-10-8-19(7-4-2)9-11-20/h8-15,22H,3-7,16-18H2,1-2H3