4-[7-(4-cyanophenyl)-1,8-diphenyl-octan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[7-(4-cyanophenyl)-1,8-diphenyl-octan-2-yl]benzenecarbonitrile Openeye Name: 4-[1-benzyl-6-(4-cyanophenyl)-7-phenyl-heptyl]benzonitrile CAS Name: 4-[7-(4-cyanophenyl)-1,8-diphenyloctan-2-yl]benzonitrile IUPAC Name: 4-[7-(4-cyanophenyl)-1,8-diphenyloctan-2-yl]benzonitrile Traditional Name: 4-[1-benzyl-6-(4-cyanophenyl)-7-phenyl-heptyl]benzonitrile Formula: C34H32N2 MolecularWeight: 468.63128

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCCCC(CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CC(CCCCC(CC2=CC=CC=C2)C3=CC=C(C=C3)C#N)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C34H32N2/c35-25-29-15-19-31(20-16-29)33(23-27-9-3-1-4-10-27)13-7-8-14-34(24-28-11-5-2-6-12-28)32-21-17-30(26-36)18-22-32/h1-6,9-12,15-22,33-34H,7-8,13-14,23-24H2