4-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carbonitrile Openeye Name: 4-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarbonitrile CAS Name: 4-(1-pentyl-4-bicyclo[2.2.2]octanyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carbonitrile Traditional Name: 4-(1-amyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarbonitrile Formula: C20H33N MolecularWeight: 287.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC12CCC(CC1)(CC2)C3CCC(CC3)C#N

Isomeric SMILES

CCCCCC12CCC(CC1)(CC2)C3CCC(CC3)C#N

InChI

InChI=1S/C20H33N/c1-2-3-4-9-19-10-13-20(14-11-19,15-12-19)18-7-5-17(16-21)6-8-18/h17-18H,2-15H2,1H3