2-[4-(4-heptylphenyl)phenyl]-5-hexyl-1,4-dioxane

Systemtic Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-1,4-dioxane Openeye Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-1,4-dioxane CAS Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-1,4-dioxane IUPAC Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-1,4-dioxane Traditional Name: 2-[4-(4-heptylphenyl)phenyl]-5-hexyl-1,4-dioxane Formula: C29H42O2 MolecularWeight: 422.64258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3COC(CO3)CCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3COC(CO3)CCCCCC

InChI

InChI=1S/C29H42O2/c1-3-5-7-9-10-12-24-14-16-25(17-15-24)26-18-20-27(21-19-26)29-23-30-28(22-31-29)13-11-8-6-4-2/h14-21,28-29H,3-13,22-23H2,1-2H3