2-heptyl-2-[4-(4-octoxyphenyl)phenyl]-1,3-dioxane

Systemtic Name: 2-heptyl-2-[4-(4-octoxyphenyl)phenyl]-1,3-dioxane Openeye Name: 2-heptyl-2-[4-(4-octoxyphenyl)phenyl]-1,3-dioxane CAS Name: 2-heptyl-2-[4-(4-octoxyphenyl)phenyl]-1,3-dioxane IUPAC Name: 2-heptyl-2-[4-(4-octoxyphenyl)phenyl]-1,3-dioxane Traditional Name: 2-heptyl-2-[4-(4-octoxyphenyl)phenyl]-1,3-dioxane Formula: C31H46O3 MolecularWeight: 466.69514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3(OCCCO3)CCCCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3(OCCCO3)CCCCCCC

InChI

InChI=1S/C31H46O3/c1-3-5-7-9-11-13-24-32-30-21-17-28(18-22-30)27-15-19-29(20-16-27)31(33-25-14-26-34-31)23-12-10-8-6-4-2/h15-22H,3-14,23-26H2,1-2H3