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

Systemtic Name: (4-butylphenyl) 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylate Openeye Name: (4-butylphenyl) 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylate CAS Name: 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylic acid (4-butylphenyl) ester IUPAC Name: (4-butylphenyl) 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylate Traditional Name: 5-methyl-2-(4-propylphenyl)-1,3-dioxane-5-carboxylic acid (4-butylphenyl) ester Formula: C25H32O4 MolecularWeight: 396.51918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)OC(=O)C2(COC(OC2)C3=CC=C(C=C3)CCC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)OC(=O)C2(COC(OC2)C3=CC=C(C=C3)CCC)C

InChI

InChI=1S/C25H32O4/c1-4-6-8-20-11-15-22(16-12-20)29-24(26)25(3)17-27-23(28-18-25)21-13-9-19(7-5-2)10-14-21/h9-16,23H,4-8,17-18H2,1-3H3