2-[2-(4-hexylcyclohexyl)ethyl]-4-oct-1-ynyl-1-(2-phenylethynyl)benzene

Systemtic Name: 2-[2-(4-hexylcyclohexyl)ethyl]-4-oct-1-ynyl-1-(2-phenylethynyl)benzene Openeye Name: 2-[2-(4-hexylcyclohexyl)ethyl]-4-oct-1-ynyl-1-(2-phenylethynyl)benzene CAS Name: 2-[2-(4-hexylcyclohexyl)ethyl]-4-oct-1-ynyl-1-(2-phenylethynyl)benzene IUPAC Name: 2-[2-(4-hexylcyclohexyl)ethyl]-4-oct-1-ynyl-1-(2-phenylethynyl)benzene Traditional Name: 2-[2-(4-hexylcyclohexyl)ethyl]-4-oct-1-ynyl-1-(2-phenylethynyl)benzene Formula: C36H48 MolecularWeight: 480.76632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CC1=CC(=C(C=C1)C#CC2=CC=CC=C2)CCC3CCC(CC3)CCCCCC

Isomeric SMILES

CCCCCCC#CC1=CC(=C(C=C1)C#CC2=CC=CC=C2)CCC3CCC(CC3)CCCCCC

InChI

InChI=1S/C36H48/c1-3-5-7-9-10-13-19-34-26-28-35(27-24-31-16-14-11-15-17-31)36(30-34)29-25-33-22-20-32(21-23-33)18-12-8-6-4-2/h11,14-17,26,28,30,32-33H,3-10,12,18,20-23,25,29H2,1-2H3