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

Systemtic Name: 2-(4-butylcyclohexyl)-5-propyl-1,3-dioxane-5-carbonitrile Openeye Name: 2-(4-butylcyclohexyl)-5-propyl-1,3-dioxane-5-carbonitrile CAS Name: 2-(4-butylcyclohexyl)-5-propyl-1,3-dioxane-5-carbonitrile IUPAC Name: 2-(4-butylcyclohexyl)-5-propyl-1,3-dioxane-5-carbonitrile Traditional Name: 2-(4-butylcyclohexyl)-5-propyl-1,3-dioxane-5-carbonitrile Formula: C18H31NO2 MolecularWeight: 293.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2OCC(CO2)(CCC)C#N

Isomeric SMILES

CCCCC1CCC(CC1)C2OCC(CO2)(CCC)C#N

InChI

InChI=1S/C18H31NO2/c1-3-5-6-15-7-9-16(10-8-15)17-20-13-18(12-19,11-4-2)14-21-17/h15-17H,3-11,13-14H2,1-2H3