2-[4-[4-(4-octoxyphenyl)phenyl]cyclohexyl]nonanenitrile

Systemtic Name: 2-[4-[4-(4-octoxyphenyl)phenyl]cyclohexyl]nonanenitrile Openeye Name: 2-[4-[4-(4-octoxyphenyl)phenyl]cyclohexyl]nonanenitrile CAS Name: 2-[4-[4-(4-octoxyphenyl)phenyl]cyclohexyl]nonanenitrile IUPAC Name: 2-[4-[4-(4-octoxyphenyl)phenyl]cyclohexyl]nonanenitrile Traditional Name: 2-[4-[4-(4-octoxyphenyl)phenyl]cyclohexyl]pelargononitrile Formula: C35H51NO MolecularWeight: 501.78554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)C(CCCCCCC)C#N

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)C(CCCCCCC)C#N

InChI

InChI=1S/C35H51NO/c1-3-5-7-9-11-13-27-37-35-25-23-32(24-26-35)31-17-15-29(16-18-31)30-19-21-33(22-20-30)34(28-36)14-12-10-8-6-4-2/h15-18,23-26,30,33-34H,3-14,19-22,27H2,1-2H3