4-[4-(4-heptylphenyl)phenyl]-1-hexyl-cyclohexane-1-carbonitrile

Systemtic Name: 4-[4-(4-heptylphenyl)phenyl]-1-hexyl-cyclohexane-1-carbonitrile Openeye Name: 4-[4-(4-heptylphenyl)phenyl]-1-hexyl-cyclohexanecarbonitrile CAS Name: 4-[4-(4-heptylphenyl)phenyl]-1-hexyl-1-cyclohexanecarbonitrile IUPAC Name: 4-[4-(4-heptylphenyl)phenyl]-1-hexylcyclohexane-1-carbonitrile Traditional Name: 4-[4-(4-heptylphenyl)phenyl]-1-hexyl-cyclohexanecarbonitrile Formula: C32H45N MolecularWeight: 443.7064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCCCC)C#N

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(CCCCCC)C#N

InChI

InChI=1S/C32H45N/c1-3-5-7-9-10-12-27-13-15-28(16-14-27)29-17-19-30(20-18-29)31-21-24-32(26-33,25-22-31)23-11-8-6-4-2/h13-20,31H,3-12,21-25H2,1-2H3