1-(4-butylcyclohexen-1-yl)-4-[2-(4-pentoxyphenyl)ethynyl]benzene

Systemtic Name: 1-(4-butylcyclohexen-1-yl)-4-[2-(4-pentoxyphenyl)ethynyl]benzene Openeye Name: 1-(4-butylcyclohexen-1-yl)-4-[2-(4-pentoxyphenyl)ethynyl]benzene CAS Name: 1-(4-butyl-1-cyclohexenyl)-4-[2-(4-pentoxyphenyl)ethynyl]benzene IUPAC Name: 1-(4-butylcyclohexen-1-yl)-4-[2-(4-pentoxyphenyl)ethynyl]benzene Traditional Name: 1-amoxy-4-[2-[4-(4-butylcyclohexen-1-yl)phenyl]ethynyl]benzene Formula: C29H36O MolecularWeight: 400.59554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CCC(CC3)CCCC

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CCC(CC3)CCCC

InChI

InChI=1S/C29H36O/c1-3-5-7-23-30-29-21-15-26(16-22-29)10-9-25-13-19-28(20-14-25)27-17-11-24(12-18-27)8-6-4-2/h13-17,19-22,24H,3-8,11-12,18,23H2,1-2H3