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

Systemtic Name: 4-[4-[3-(4-octylcyclohexyl)propoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[3-(4-octylcyclohexyl)propoxy]phenyl]benzonitrile CAS Name: 4-[4-[3-(4-octylcyclohexyl)propoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[3-(4-octylcyclohexyl)propoxy]phenyl]benzonitrile Traditional Name: 4-[4-[3-(4-octylcyclohexyl)propoxy]phenyl]benzonitrile Formula: C30H41NO MolecularWeight: 431.65264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C30H41NO/c1-2-3-4-5-6-7-9-25-11-13-26(14-12-25)10-8-23-32-30-21-19-29(20-22-30)28-17-15-27(24-31)16-18-28/h15-22,25-26H,2-14,23H2,1H3