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

Systemtic Name: 4-[4-(4-octylcyclohexyl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(4-octylcyclohexyl)phenyl]benzonitrile CAS Name: 4-[4-(4-octylcyclohexyl)phenyl]benzonitrile IUPAC Name: 4-[4-(4-octylcyclohexyl)phenyl]benzonitrile Traditional Name: 4-[4-(4-octylcyclohexyl)phenyl]benzonitrile Formula: C27H35N MolecularWeight: 373.5735

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35N/c1-2-3-4-5-6-7-8-22-9-13-24(14-10-22)26-17-19-27(20-18-26)25-15-11-23(21-28)12-16-25/h11-12,15-20,22,24H,2-10,13-14H2,1H3