2-[2-(4-heptylcyclohexyl)ethyl]-4-non-1-ynyl-1-(2-phenylethynyl)benzene

Systemtic Name: 2-[2-(4-heptylcyclohexyl)ethyl]-4-non-1-ynyl-1-(2-phenylethynyl)benzene Openeye Name: 2-[2-(4-heptylcyclohexyl)ethyl]-4-non-1-ynyl-1-(2-phenylethynyl)benzene CAS Name: 2-[2-(4-heptylcyclohexyl)ethyl]-4-non-1-ynyl-1-(2-phenylethynyl)benzene IUPAC Name: 2-[2-(4-heptylcyclohexyl)ethyl]-4-non-1-ynyl-1-(2-phenylethynyl)benzene Traditional Name: 2-[2-(4-heptylcyclohexyl)ethyl]-4-non-1-ynyl-1-(2-phenylethynyl)benzene Formula: C38H52 MolecularWeight: 508.81948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H52/c1-3-5-7-9-10-12-15-21-36-28-30-37(29-26-33-18-16-13-17-19-33)38(32-36)31-27-35-24-22-34(23-25-35)20-14-11-8-6-4-2/h13,16-19,28,30,32,34-35H,3-12,14,20,22-25,27,31H2,1-2H3