1-heptoxy-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene

Systemtic Name: 1-heptoxy-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene Openeye Name: 1-heptoxy-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene CAS Name: 1-heptoxy-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene IUPAC Name: 1-heptoxy-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene Traditional Name: 1-heptoxy-4-[4-[2-(4-hexylcyclohexyl)ethynyl]phenyl]benzene Formula: C33H46O MolecularWeight: 458.71774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)CCCCCC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#CC3CCC(CC3)CCCCCC

InChI

InChI=1S/C33H46O/c1-3-5-7-9-11-27-34-33-25-23-32(24-26-33)31-21-19-30(20-22-31)18-17-29-15-13-28(14-16-29)12-10-8-6-4-2/h19-26,28-29H,3-16,27H2,1-2H3