1-butyl-4-[4-[2-(4-pentylphenyl)ethynyl]cyclohex-3-en-1-yl]benzene

Systemtic Name: 1-butyl-4-[4-[2-(4-pentylphenyl)ethynyl]cyclohex-3-en-1-yl]benzene Openeye Name: 1-butyl-4-[4-[2-(4-pentylphenyl)ethynyl]cyclohex-3-en-1-yl]benzene CAS Name: 1-butyl-4-[4-[2-(4-pentylphenyl)ethynyl]-1-cyclohex-3-enyl]benzene IUPAC Name: 1-butyl-4-[4-[2-(4-pentylphenyl)ethynyl]cyclohex-3-en-1-yl]benzene Traditional Name: 1-amyl-4-[2-[4-(4-butylphenyl)cyclohexen-1-yl]ethynyl]benzene Formula: C29H36 MolecularWeight: 384.59614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C#CC2=CCC(CC2)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C#CC2=CCC(CC2)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C29H36/c1-3-5-7-9-25-10-12-26(13-11-25)14-15-27-18-22-29(23-19-27)28-20-16-24(17-21-28)8-6-4-2/h10-13,16-18,20-21,29H,3-9,19,22-23H2,1-2H3