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

Systemtic Name: (4-heptylcyclohexyl) 2-butyl-5-cyano-1,3-dioxane-5-carboxylate Openeye Name: (4-heptylcyclohexyl) 2-butyl-5-cyano-1,3-dioxane-5-carboxylate CAS Name: 2-butyl-5-cyano-1,3-dioxane-5-carboxylic acid (4-heptylcyclohexyl) ester IUPAC Name: (4-heptylcyclohexyl) 2-butyl-5-cyano-1,3-dioxane-5-carboxylate Traditional Name: 2-butyl-5-cyano-1,3-dioxane-5-carboxylic acid (4-heptylcyclohexyl) ester Formula: C23H39NO4 MolecularWeight: 393.56006

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)OC(=O)C2(COC(OC2)CCCC)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)OC(=O)C2(COC(OC2)CCCC)C#N

InChI

InChI=1S/C23H39NO4/c1-3-5-7-8-9-10-19-12-14-20(15-13-19)28-22(25)23(16-24)17-26-21(27-18-23)11-6-4-2/h19-21H,3-15,17-18H2,1-2H3