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

Systemtic Name: 5-pentyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile Openeye Name: 5-pentyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile CAS Name: 5-pentyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile IUPAC Name: 5-pentyl-2-[4-(4-pentylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile Traditional Name: 5-amyl-2-[4-(4-amylcyclohexyl)cyclohexyl]-1,3-dioxane-5-carbonitrile Formula: C27H47NO2 MolecularWeight: 417.66758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2CCC(CC2)C3OCC(CO3)(CCCCC)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C2CCC(CC2)C3OCC(CO3)(CCCCC)C#N

InChI

InChI=1S/C27H47NO2/c1-3-5-7-9-22-10-12-23(13-11-22)24-14-16-25(17-15-24)26-29-20-27(19-28,21-30-26)18-8-6-4-2/h22-26H,3-18,20-21H2,1-2H3