5-heptyl-5-methyl-2-(4-pentylphenyl)-1,3-dioxane

Systemtic Name: 5-heptyl-5-methyl-2-(4-pentylphenyl)-1,3-dioxane Openeye Name: 5-heptyl-5-methyl-2-(4-pentylphenyl)-1,3-dioxane CAS Name: 5-heptyl-5-methyl-2-(4-pentylphenyl)-1,3-dioxane IUPAC Name: 5-heptyl-5-methyl-2-(4-pentylphenyl)-1,3-dioxane Traditional Name: 2-(4-amylphenyl)-5-heptyl-5-methyl-1,3-dioxane Formula: C23H38O2 MolecularWeight: 346.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(COC(OC1)C2=CC=C(C=C2)CCCCC)C

Isomeric SMILES

CCCCCCCC1(COC(OC1)C2=CC=C(C=C2)CCCCC)C

InChI

InChI=1S/C23H38O2/c1-4-6-8-9-11-17-23(3)18-24-22(25-19-23)21-15-13-20(14-16-21)12-10-7-5-2/h13-16,22H,4-12,17-19H2,1-3H3