5-heptyl-2-methyl-2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-1,3-dioxane

Systemtic Name: 5-heptyl-2-methyl-2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-1,3-dioxane Openeye Name: 5-heptyl-2-methyl-2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-1,3-dioxane CAS Name: 5-heptyl-2-methyl-2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-1,3-dioxane IUPAC Name: 5-heptyl-2-methyl-2-[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]-1,3-dioxane Traditional Name: 2-[4-[4-(4-amylcyclohexyl)phenyl]phenyl]-5-heptyl-2-methyl-1,3-dioxane Formula: C35H52O2 MolecularWeight: 504.78618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)(C)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCCCC

Isomeric SMILES

CCCCCCCC1COC(OC1)(C)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)CCCCC

InChI

InChI=1S/C35H52O2/c1-4-6-8-9-11-13-29-26-36-35(3,37-27-29)34-24-22-33(23-25-34)32-20-18-31(19-21-32)30-16-14-28(15-17-30)12-10-7-5-2/h18-25,28-30H,4-17,26-27H2,1-3H3