4-[4-(4-octylphenyl)cyclohexyl]benzenecarbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2CCC(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2CCC(CC2)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/h9-16,26-27H,2-8,17-20H2,1H3