2-(4-butylcyclohexyl)-2-pentyl-1,3-dioxane-5-carbonitrile

Systemtic Name: 2-(4-butylcyclohexyl)-2-pentyl-1,3-dioxane-5-carbonitrile Openeye Name: 2-(4-butylcyclohexyl)-2-pentyl-1,3-dioxane-5-carbonitrile CAS Name: 2-(4-butylcyclohexyl)-2-pentyl-1,3-dioxane-5-carbonitrile IUPAC Name: 2-(4-butylcyclohexyl)-2-pentyl-1,3-dioxane-5-carbonitrile Traditional Name: 2-amyl-2-(4-butylcyclohexyl)-1,3-dioxane-5-carbonitrile Formula: C20H35NO2 MolecularWeight: 321.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(OCC(CO1)C#N)C2CCC(CC2)CCCC

Isomeric SMILES

CCCCCC1(OCC(CO1)C#N)C2CCC(CC2)CCCC

InChI

InChI=1S/C20H35NO2/c1-3-5-7-13-20(22-15-18(14-21)16-23-20)19-11-9-17(10-12-19)8-6-4-2/h17-19H,3-13,15-16H2,1-2H3