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

Systemtic Name: 2-(4-butylcyclohexyl)-5-heptyl-1,3-dioxane-5-carbonitrile Openeye Name: 2-(4-butylcyclohexyl)-5-heptyl-1,3-dioxane-5-carbonitrile CAS Name: 2-(4-butylcyclohexyl)-5-heptyl-1,3-dioxane-5-carbonitrile IUPAC Name: 2-(4-butylcyclohexyl)-5-heptyl-1,3-dioxane-5-carbonitrile Traditional Name: 2-(4-butylcyclohexyl)-5-heptyl-1,3-dioxane-5-carbonitrile Formula: C22H39NO2 MolecularWeight: 349.55056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(COC(OC1)C2CCC(CC2)CCCC)C#N

Isomeric SMILES

CCCCCCCC1(COC(OC1)C2CCC(CC2)CCCC)C#N

InChI

InChI=1S/C22H39NO2/c1-3-5-7-8-9-15-22(16-23)17-24-21(25-18-22)20-13-11-19(12-14-20)10-6-4-2/h19-21H,3-15,17-18H2,1-2H3