1-hexoxy-4-[2-[4-(4-pentylcyclohexen-1-yl)phenyl]ethynyl]benzene

Systemtic Name: 1-hexoxy-4-[2-[4-(4-pentylcyclohexen-1-yl)phenyl]ethynyl]benzene Openeye Name: 1-hexoxy-4-[2-[4-(4-pentylcyclohexen-1-yl)phenyl]ethynyl]benzene CAS Name: 1-hexoxy-4-[2-[4-(4-pentyl-1-cyclohexenyl)phenyl]ethynyl]benzene IUPAC Name: 1-hexoxy-4-[2-[4-(4-pentylcyclohexen-1-yl)phenyl]ethynyl]benzene Traditional Name: 1-(4-amylcyclohexen-1-yl)-4-[2-(4-hexoxyphenyl)ethynyl]benzene Formula: C31H40O MolecularWeight: 428.6487

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C#CC2=CC=C(C=C2)C3=CCC(CC3)CCCCC

InChI

InChI=1S/C31H40O/c1-3-5-7-9-25-32-31-23-17-28(18-24-31)12-11-27-15-21-30(22-16-27)29-19-13-26(14-20-29)10-8-6-4-2/h15-19,21-24,26H,3-10,13-14,20,25H2,1-2H3