2-[2-(4-ethylcyclohexyl)ethyl]-4-hept-1-ynyl-1-(2-phenylethynyl)benzene

Systemtic Name: 2-[2-(4-ethylcyclohexyl)ethyl]-4-hept-1-ynyl-1-(2-phenylethynyl)benzene Openeye Name: 2-[2-(4-ethylcyclohexyl)ethyl]-4-hept-1-ynyl-1-(2-phenylethynyl)benzene CAS Name: 2-[2-(4-ethylcyclohexyl)ethyl]-4-hept-1-ynyl-1-(2-phenylethynyl)benzene IUPAC Name: 2-[2-(4-ethylcyclohexyl)ethyl]-4-hept-1-ynyl-1-(2-phenylethynyl)benzene Traditional Name: 2-[2-(4-ethylcyclohexyl)ethyl]-4-hept-1-ynyl-1-(2-phenylethynyl)benzene Formula: C31H38 MolecularWeight: 410.63342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H38/c1-3-5-6-7-9-14-29-21-23-30(22-19-27-12-10-8-11-13-27)31(25-29)24-20-28-17-15-26(4-2)16-18-28/h8,10-13,21,23,25-26,28H,3-7,15-18,20,24H2,1-2H3