1-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]-4-(4-hexylphenyl)benzene

Systemtic Name: 1-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]-4-(4-hexylphenyl)benzene Openeye Name: 1-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]-4-(4-hexylphenyl)benzene CAS Name: 1-[2-[4-(4-butylcyclohexyl)-1-cyclohexenyl]ethynyl]-4-(4-hexylphenyl)benzene IUPAC Name: 1-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]-4-(4-hexylphenyl)benzene Traditional Name: 1-[2-[4-(4-butylcyclohexyl)cyclohexen-1-yl]ethynyl]-4-(4-hexylphenyl)benzene Formula: C36H48 MolecularWeight: 480.76632

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3=CCC(CC3)C4CCC(CC4)CCCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3=CCC(CC3)C4CCC(CC4)CCCC

InChI

InChI=1S/C36H48/c1-3-5-7-8-10-30-15-23-34(24-16-30)36-27-19-32(20-28-36)12-11-31-17-25-35(26-18-31)33-21-13-29(14-22-33)9-6-4-2/h15-17,19-20,23-24,27-29,33,35H,3-10,13-14,18,21-22,25-26H2,1-2H3