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

Systemtic Name: 1-heptyl-4-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carbonitrile Openeye Name: 1-heptyl-4-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexanecarbonitrile CAS Name: 1-heptyl-4-(1-pentyl-4-bicyclo[2.2.2]octanyl)-1-cyclohexanecarbonitrile IUPAC Name: 1-heptyl-4-(1-pentyl-4-bicyclo[2.2.2]octanyl)cyclohexane-1-carbonitrile Traditional Name: 4-(1-amyl-4-bicyclo[2.2.2]octanyl)-1-heptyl-cyclohexanecarbonitrile Formula: C27H47N MolecularWeight: 385.66878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)C23CCC(CC2)(CC3)CCCCC)C#N

Isomeric SMILES

CCCCCCCC1(CCC(CC1)C23CCC(CC2)(CC3)CCCCC)C#N

InChI

InChI=1S/C27H47N/c1-3-5-7-8-10-14-26(23-28)15-11-24(12-16-26)27-20-17-25(18-21-27,19-22-27)13-9-6-4-2/h24H,3-22H2,1-2H3