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

Systemtic Name: 1-butoxy-4-[2-[4-(4-pentylcyclohexen-1-yl)phenyl]ethynyl]benzene Openeye Name: 1-butoxy-4-[2-[4-(4-pentylcyclohexen-1-yl)phenyl]ethynyl]benzene CAS Name: 1-butoxy-4-[2-[4-(4-pentyl-1-cyclohexenyl)phenyl]ethynyl]benzene IUPAC Name: 1-butoxy-4-[2-[4-(4-pentylcyclohexen-1-yl)phenyl]ethynyl]benzene Traditional Name: 1-(4-amylcyclohexen-1-yl)-4-[2-(4-butoxyphenyl)ethynyl]benzene Formula: C29H36O MolecularWeight: 400.59554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(=CC1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCC1CCC(=CC1)C2=CC=C(C=C2)C#CC3=CC=C(C=C3)OCCCC

InChI

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