1-butyl-4-[2-[4-[4-(4-butylcyclohexyl)phenyl]phenyl]ethynyl]benzene

Systemtic Name: 1-butyl-4-[2-[4-[4-(4-butylcyclohexyl)phenyl]phenyl]ethynyl]benzene Openeye Name: 1-butyl-4-[2-[4-[4-(4-butylcyclohexyl)phenyl]phenyl]ethynyl]benzene CAS Name: 1-butyl-4-[2-[4-[4-(4-butylcyclohexyl)phenyl]phenyl]ethynyl]benzene IUPAC Name: 1-butyl-4-[2-[4-[4-(4-butylcyclohexyl)phenyl]phenyl]ethynyl]benzene Traditional Name: 1-butyl-4-[2-[4-[4-(4-butylcyclohexyl)phenyl]phenyl]ethynyl]benzene Formula: C34H40 MolecularWeight: 448.6814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#CC4=CC=C(C=C4)CCCC

Isomeric SMILES

CCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C#CC4=CC=C(C=C4)CCCC

InChI

InChI=1S/C34H40/c1-3-5-7-27-9-11-29(12-10-27)13-14-30-17-21-32(22-18-30)34-25-23-33(24-26-34)31-19-15-28(16-20-31)8-6-4-2/h9-12,17-18,21-26,28,31H,3-8,15-16,19-20H2,1-2H3