5-heptyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile

Systemtic Name: 5-heptyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile Openeye Name: 5-heptyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile CAS Name: 5-heptyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile IUPAC Name: 5-heptyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile Traditional Name: 2-[4-(4-amylcyclohexyl)cyclohexyl]-5-heptyl-1,3-dioxane-5-carbonitrile Formula: C29H51NO2 MolecularWeight: 445.72074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(COC(OC1)C2CCC(CC2)C3CCC(CC3)CCCCC)C#N

Isomeric SMILES

CCCCCCCC1(COC(OC1)C2CCC(CC2)C3CCC(CC3)CCCCC)C#N

InChI

InChI=1S/C29H51NO2/c1-3-5-7-8-10-20-29(21-30)22-31-28(32-23-29)27-18-16-26(17-19-27)25-14-12-24(13-15-25)11-9-6-4-2/h24-28H,3-20,22-23H2,1-2H3