(4-butylcyclohexyl) 2-butyl-5-cyano-1,3-dioxane-5-carboxylate

Systemtic Name: (4-butylcyclohexyl) 2-butyl-5-cyano-1,3-dioxane-5-carboxylate Openeye Name: (4-butylcyclohexyl) 2-butyl-5-cyano-1,3-dioxane-5-carboxylate CAS Name: 2-butyl-5-cyano-1,3-dioxane-5-carboxylic acid (4-butylcyclohexyl) ester IUPAC Name: (4-butylcyclohexyl) 2-butyl-5-cyano-1,3-dioxane-5-carboxylate Traditional Name: 2-butyl-5-cyano-1,3-dioxane-5-carboxylic acid (4-butylcyclohexyl) ester Formula: C20H33NO4 MolecularWeight: 351.48032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)OC(=O)C2(COC(OC2)CCCC)C#N

Isomeric SMILES

CCCCC1CCC(CC1)OC(=O)C2(COC(OC2)CCCC)C#N

InChI

InChI=1S/C20H33NO4/c1-3-5-7-16-9-11-17(12-10-16)25-19(22)20(13-21)14-23-18(24-15-20)8-6-4-2/h16-18H,3-12,14-15H2,1-2H3