4-[4-[2-(4-butylcyclohexyl)ethyl]phenyl]-1-heptyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-[2-(4-butylcyclohexyl)ethyl]phenyl]-1-heptyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-[2-(4-butylcyclohexyl)ethyl]phenyl]-1-heptyl-cyclohexanecarbonitrile CAS Name: 4-[4-[2-(4-butylcyclohexyl)ethyl]phenyl]-1-heptyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-[2-(4-butylcyclohexyl)ethyl]phenyl]-1-heptylcyclohexane-1-carbonitrile Traditional Name: 4-[4-[2-(4-butylcyclohexyl)ethyl]phenyl]-1-heptyl-cyclohexanecarbonitrile Formula: C32H51N MolecularWeight: 449.75404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)CCC3CCC(CC3)CCCC)C#N

Isomeric SMILES

CCCCCCCC1(CCC(CC1)C2=CC=C(C=C2)CCC3CCC(CC3)CCCC)C#N

InChI

InChI=1S/C32H51N/c1-3-5-7-8-9-23-32(26-33)24-21-31(22-25-32)30-19-17-29(18-20-30)16-15-28-13-11-27(12-14-28)10-6-4-2/h17-20,27-28,31H,3-16,21-25H2,1-2H3