2-[4-(1-propyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]ethanenitrile

Systemtic Name: 2-[4-(1-propyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]ethanenitrile Openeye Name: 2-[4-(1-propyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]acetonitrile CAS Name: 2-[4-(1-propyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]acetonitrile IUPAC Name: 2-[4-(1-propyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]acetonitrile Traditional Name: 2-[4-(1-propyl-4-bicyclo[2.2.2]octanyl)cyclohexyl]acetonitrile Formula: C19H31N MolecularWeight: 273.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCCC12CCC(CC1)(CC2)C3CCC(CC3)CC#N

Isomeric SMILES

CCCC12CCC(CC1)(CC2)C3CCC(CC3)CC#N

InChI

InChI=1S/C19H31N/c1-2-8-18-9-12-19(13-10-18,14-11-18)17-5-3-16(4-6-17)7-15-20/h16-17H,2-14H2,1H3