1-hexyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile

Systemtic Name: 1-hexyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile Openeye Name: 1-hexyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexanecarbonitrile CAS Name: 1-hexyl-4-(5-propyl-1,3-dioxan-2-yl)-1-cyclohexanecarbonitrile IUPAC Name: 1-hexyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile Traditional Name: 1-hexyl-4-(5-propyl-1,3-dioxan-2-yl)cyclohexanecarbonitrile Formula: C20H35NO2 MolecularWeight: 321.4974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(CCC(CC1)C2OCC(CO2)CCC)C#N

Isomeric SMILES

CCCCCCC1(CCC(CC1)C2OCC(CO2)CCC)C#N

InChI

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