2-heptyl-5-[4-(4-pentylphenyl)phenyl]-1,4-dioxane

Systemtic Name: 2-heptyl-5-[4-(4-pentylphenyl)phenyl]-1,4-dioxane Openeye Name: 2-heptyl-5-[4-(4-pentylphenyl)phenyl]-1,4-dioxane CAS Name: 2-heptyl-5-[4-(4-pentylphenyl)phenyl]-1,4-dioxane IUPAC Name: 2-heptyl-5-[4-(4-pentylphenyl)phenyl]-1,4-dioxane Traditional Name: 2-[4-(4-amylphenyl)phenyl]-5-heptyl-1,4-dioxane Formula: C28H40O2 MolecularWeight: 408.616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

Isomeric SMILES

CCCCCCCC1COC(CO1)C2=CC=C(C=C2)C3=CC=C(C=C3)CCCCC

InChI

InChI=1S/C28H40O2/c1-3-5-7-8-10-12-27-21-30-28(22-29-27)26-19-17-25(18-20-26)24-15-13-23(14-16-24)11-9-6-4-2/h13-20,27-28H,3-12,21-22H2,1-2H3