(4-butoxyphenyl) 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylate

Systemtic Name: (4-butoxyphenyl) 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylate Openeye Name: (4-butoxyphenyl) 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylate CAS Name: 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylic acid (4-butoxyphenyl) ester IUPAC Name: (4-butoxyphenyl) 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylate Traditional Name: 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylic acid (4-butoxyphenyl) ester Formula: C25H32O5 MolecularWeight: 412.51858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)OC(=O)C2(COC(OC2)C3=CC=C(C=C3)CCC)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)OC(=O)C2(COC(OC2)C3=CC=C(C=C3)CCC)C

InChI

InChI=1S/C25H32O5/c1-4-6-16-27-21-12-14-22(15-13-21)30-24(26)25(3)17-28-23(29-18-25)20-10-8-19(7-5-2)9-11-20/h8-15,23H,4-7,16-18H2,1-3H3