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

Systemtic Name: 4-[4-(4-dodecylcyclohexyl)phenyl]benzenecarbonitrile Openeye Name: 4-[4-(4-dodecylcyclohexyl)phenyl]benzonitrile CAS Name: 4-[4-(4-dodecylcyclohexyl)phenyl]benzonitrile IUPAC Name: 4-[4-(4-dodecylcyclohexyl)phenyl]benzonitrile Traditional Name: 4-[4-(4-laurylcyclohexyl)phenyl]benzonitrile Formula: C31H43N MolecularWeight: 429.67982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCCCCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C31H43N/c1-2-3-4-5-6-7-8-9-10-11-12-26-13-17-28(18-14-26)30-21-23-31(24-22-30)29-19-15-27(25-32)16-20-29/h15-16,19-24,26,28H,2-14,17-18H2,1H3