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

Systemtic Name: 2-[4-(4-butylphenyl)phenyl]-5-heptyl-1,4-dioxane Openeye Name: 2-[4-(4-butylphenyl)phenyl]-5-heptyl-1,4-dioxane CAS Name: 2-[4-(4-butylphenyl)phenyl]-5-heptyl-1,4-dioxane IUPAC Name: 2-[4-(4-butylphenyl)phenyl]-5-heptyl-1,4-dioxane Traditional Name: 2-[4-(4-butylphenyl)phenyl]-5-heptyl-1,4-dioxane Formula: C27H38O2 MolecularWeight: 394.58942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H38O2/c1-3-5-7-8-9-11-26-20-29-27(21-28-26)25-18-16-24(17-19-25)23-14-12-22(13-15-23)10-6-4-2/h12-19,26-27H,3-11,20-21H2,1-2H3