1-heptyl-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene

Systemtic Name: 1-heptyl-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene Openeye Name: 1-heptyl-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene CAS Name: 1-heptyl-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene IUPAC Name: 1-heptyl-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene Traditional Name: 1-heptyl-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene Formula: C33H46 MolecularWeight: 442.71834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)CCCCCC

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)CCCCCC

InChI

InChI=1S/C33H46/c1-3-5-7-9-11-13-29-20-24-32(25-21-29)33-26-22-31(23-27-33)19-18-30-16-14-28(15-17-30)12-10-8-6-4-2/h20-28,30H,3-17H2,1-2H3