4-[4-cyclohexyl-1-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]butanenitrile

Systemtic Name: 4-[4-cyclohexyl-1-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]butanenitrile Openeye Name: 4-[4-cyclohexyl-1-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]butanenitrile CAS Name: 4-[4-cyclohexyl-1-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]butanenitrile IUPAC Name: 4-[4-cyclohexyl-1-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]butanenitrile Traditional Name: 4-[1-(1-amyl-4-bicyclo[2.2.2]octanyl)-4-cyclohexyl-cyclohexyl]butyronitrile Formula: C29H49N MolecularWeight: 411.70606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC12CCC(CC1)(CC2)C3(CCC(CC3)C4CCCCC4)CCCC#N

Isomeric SMILES

CCCCCC12CCC(CC1)(CC2)C3(CCC(CC3)C4CCCCC4)CCCC#N

InChI

InChI=1S/C29H49N/c1-2-3-7-14-27-18-21-29(22-19-27,23-20-27)28(15-8-9-24-30)16-12-26(13-17-28)25-10-5-4-6-11-25/h25-26H,2-23H2,1H3