4-[[4-[4-[2-(4-pentylphenyl)ethynyl]phenyl]cyclohexylidene]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[4-[2-(4-pentylphenyl)ethynyl]phenyl]cyclohexylidene]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[4-[2-(4-pentylphenyl)ethynyl]phenyl]cyclohexylidene]methyl]benzonitrile CAS Name: 4-[[4-[4-[2-(4-pentylphenyl)ethynyl]phenyl]cyclohexylidene]methyl]benzonitrile IUPAC Name: 4-[[4-[4-[2-(4-pentylphenyl)ethynyl]phenyl]cyclohexylidene]methyl]benzonitrile Traditional Name: 4-[[4-[4-[2-(4-amylphenyl)ethynyl]phenyl]cyclohexylidene]methyl]benzonitrile Formula: C33H33N MolecularWeight: 443.62182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3CCC(=CC4=CC=C(C=C4)C#N)CC3

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3CCC(=CC4=CC=C(C=C4)C#N)CC3

InChI

InChI=1S/C33H33N/c1-2-3-4-5-26-6-8-27(9-7-26)10-11-28-16-20-32(21-17-28)33-22-18-30(19-23-33)24-29-12-14-31(25-34)15-13-29/h6-9,12-17,20-21,24,33H,2-5,18-19,22-23H2,1H3