4-[4-[2-(4-methylcyclohexyl)ethynyl]phenyl]benzenecarbonitrile

Systemtic Name: 4-[4-[2-(4-methylcyclohexyl)ethynyl]phenyl]benzenecarbonitrile Openeye Name: 4-[4-[2-(4-methylcyclohexyl)ethynyl]phenyl]benzonitrile CAS Name: 4-[4-[2-(4-methylcyclohexyl)ethynyl]phenyl]benzonitrile IUPAC Name: 4-[4-[2-(4-methylcyclohexyl)ethynyl]phenyl]benzonitrile Traditional Name: 4-[4-[2-(4-methylcyclohexyl)ethynyl]phenyl]benzonitrile Formula: C22H21N MolecularWeight: 299.40884

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1CCC(CC1)C#CC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C22H21N/c1-17-2-4-18(5-3-17)6-7-19-8-12-21(13-9-19)22-14-10-20(16-23)11-15-22/h8-15,17-18H,2-5H2,1H3