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

Systemtic Name: 4-(5-heptyl-1,3-dioxan-2-yl)-1-propyl-cyclohexane-1-carbonitrile Openeye Name: 4-(5-heptyl-1,3-dioxan-2-yl)-1-propyl-cyclohexanecarbonitrile CAS Name: 4-(5-heptyl-1,3-dioxan-2-yl)-1-propyl-1-cyclohexanecarbonitrile IUPAC Name: 4-(5-heptyl-1,3-dioxan-2-yl)-1-propylcyclohexane-1-carbonitrile Traditional Name: 4-(5-heptyl-1,3-dioxan-2-yl)-1-propyl-cyclohexanecarbonitrile Formula: C21H37NO2 MolecularWeight: 335.52398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)C2CCC(CC2)(CCC)C#N

Isomeric SMILES

CCCCCCCC1COC(OC1)C2CCC(CC2)(CCC)C#N

InChI

InChI=1S/C21H37NO2/c1-3-5-6-7-8-9-18-15-23-20(24-16-18)19-10-13-21(17-22,12-4-2)14-11-19/h18-20H,3-16H2,1-2H3