4-butyl-1-(5-heptyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile

Systemtic Name: 4-butyl-1-(5-heptyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile Openeye Name: 4-butyl-1-(5-heptyl-1,3-dioxan-2-yl)cyclohexanecarbonitrile CAS Name: 4-butyl-1-(5-heptyl-1,3-dioxan-2-yl)-1-cyclohexanecarbonitrile IUPAC Name: 4-butyl-1-(5-heptyl-1,3-dioxan-2-yl)cyclohexane-1-carbonitrile Traditional Name: 4-butyl-1-(5-heptyl-1,3-dioxan-2-yl)cyclohexanecarbonitrile Formula: C22H39NO2 MolecularWeight: 349.55056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)C2(CCC(CC2)CCCC)C#N

Isomeric SMILES

CCCCCCCC1COC(OC1)C2(CCC(CC2)CCCC)C#N

InChI

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