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

Systemtic Name: 4-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]benzonitrile CAS Name: 4-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]benzonitrile IUPAC Name: 4-[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]benzonitrile Traditional Name: 4-[4-[3-(4-amylcyclohexyl)propoxy]phenyl]benzonitrile Formula: C27H35NO MolecularWeight: 389.5729

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H35NO/c1-2-3-4-6-22-8-10-23(11-9-22)7-5-20-29-27-18-16-26(17-19-27)25-14-12-24(21-28)13-15-25/h12-19,22-23H,2-11,20H2,1H3