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

Systemtic Name: 5-heptyl-2-[4-(4-methyl-4-pentyl-cyclohexyl)phenyl]-1,3-dioxane Openeye Name: 5-heptyl-2-[4-(4-methyl-4-pentyl-cyclohexyl)phenyl]-1,3-dioxane CAS Name: 5-heptyl-2-[4-(4-methyl-4-pentylcyclohexyl)phenyl]-1,3-dioxane IUPAC Name: 5-heptyl-2-[4-(4-methyl-4-pentylcyclohexyl)phenyl]-1,3-dioxane Traditional Name: 2-[4-(4-amyl-4-methyl-cyclohexyl)phenyl]-5-heptyl-1,3-dioxane Formula: C29H48O2 MolecularWeight: 428.69022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)C2=CC=C(C=C2)C3CCC(CC3)(C)CCCCC

Isomeric SMILES

CCCCCCCC1COC(OC1)C2=CC=C(C=C2)C3CCC(CC3)(C)CCCCC

InChI

InChI=1S/C29H48O2/c1-4-6-8-9-10-12-24-22-30-28(31-23-24)27-15-13-25(14-16-27)26-17-20-29(3,21-18-26)19-11-7-5-2/h13-16,24,26,28H,4-12,17-23H2,1-3H3