4-[4-(4-nonylphenyl)phenyl]-1-octyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(4-nonylphenyl)phenyl]-1-octyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-nonylphenyl)phenyl]-1-octyl-cyclohexanecarbonitrile CAS Name: 4-[4-(4-nonylphenyl)phenyl]-1-octyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-nonylphenyl)phenyl]-1-octylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-nonylphenyl)phenyl]-1-octyl-cyclohexanecarbonitrile Formula: C36H53N MolecularWeight: 499.81272

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCCCCCC)C#N

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCCCCCC)C#N

InChI

InChI=1S/C36H53N/c1-3-5-7-9-11-12-14-16-31-17-19-32(20-18-31)33-21-23-34(24-22-33)35-25-28-36(30-37,29-26-35)27-15-13-10-8-6-4-2/h17-24,35H,3-16,25-29H2,1-2H3