4-[4-[3-(4-heptylcyclohexyl)propoxy]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[3-(4-heptylcyclohexyl)propoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[3-(4-heptylcyclohexyl)propoxy]phenyl]benzonitrile CAS Name: 4-[4-[3-(4-heptylcyclohexyl)propoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[3-(4-heptylcyclohexyl)propoxy]phenyl]benzonitrile Traditional Name: 4-[4-[3-(4-heptylcyclohexyl)propoxy]phenyl]benzonitrile Formula: C29H39NO MolecularWeight: 417.62606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C29H39NO/c1-2-3-4-5-6-8-24-10-12-25(13-11-24)9-7-22-31-29-20-18-28(19-21-29)27-16-14-26(23-30)15-17-27/h14-21,24-25H,2-13,22H2,1H3