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

Systemtic Name: 1-butyl-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carbonitrile Openeye Name: 1-butyl-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarbonitrile CAS Name: 1-butyl-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)-1-cyclohexanecarbonitrile IUPAC Name: 1-butyl-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carbonitrile Traditional Name: 1-butyl-4-(1-heptyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarbonitrile Formula: C26H45N MolecularWeight: 371.6422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC12CCC(CC1)(CC2)C3CCC(CC3)(CCCC)C#N

Isomeric SMILES

CCCCCCCC12CCC(CC1)(CC2)C3CCC(CC3)(CCCC)C#N

InChI

InChI=1S/C26H45N/c1-3-5-7-8-9-13-24-16-19-26(20-17-24,21-18-24)23-10-14-25(22-27,15-11-23)12-6-4-2/h23H,3-21H2,1-2H3