4-[4-(4-heptoxyphenyl)phenyl]-1-[2-(4-pentylcyclohexyl)ethyl]cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(4-heptoxyphenyl)phenyl]-1-[2-(4-pentylcyclohexyl)ethyl]cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-heptoxyphenyl)phenyl]-1-[2-(4-pentylcyclohexyl)ethyl]cyclohexanecarbonitrile CAS Name: 4-[4-(4-heptoxyphenyl)phenyl]-1-[2-(4-pentylcyclohexyl)ethyl]-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-heptoxyphenyl)phenyl]-1-[2-(4-pentylcyclohexyl)ethyl]cyclohexane-1-carbonitrile Traditional Name: 1-[2-(4-amylcyclohexyl)ethyl]-4-[4-(4-heptoxyphenyl)phenyl]cyclohexanecarbonitrile Formula: C39H57NO MolecularWeight: 555.87598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCC4CCC(CC4)CCCCC)C#N

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCC4CCC(CC4)CCCCC)C#N

InChI

InChI=1S/C39H57NO/c1-3-5-7-8-10-30-41-38-22-20-36(21-23-38)34-16-18-35(19-17-34)37-25-28-39(31-40,29-26-37)27-24-33-14-12-32(13-15-33)11-9-6-4-2/h16-23,32-33,37H,3-15,24-30H2,1-2H3