(E)-N24,N25-bis(3,4-dibutylphenyl)pentacont-22-en-26-yne-24,25-diimine

Systemtic Name: (E)-N24,N25-bis(3,4-dibutylphenyl)pentacont-22-en-26-yne-24,25-diimine Openeye Name: (E)-N24,N25-bis(3,4-dibutylphenyl)pentacont-22-en-26-yne-24,25-diimine CAS Name: (E)-N24,N25-bis(3,4-dibutylphenyl)pentacont-22-en-26-yne-24,25-diimine IUPAC Name: (E)-24-N,25-N-bis(3,4-dibutylphenyl)pentacont-22-en-26-yne-24,25-diimine Traditional Name: (3,4-dibutylphenyl)-[2-(3,4-dibutylphenyl)imino-1-[(E)-tricos-1-enyl]heptacos-3-ynylidene]amine Formula: C78H134N2 MolecularWeight: 1099.91196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC#CC(=NC1=CC(=C(C=C1)CCCC)CCCC)C(=NC2=CC(=C(C=C2)CCCC)CCCC)C=CCCCCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC#CC(=NC1=CC(=C(C=C1)CCCC)CCCC)C(=NC2=CC(=C(C=C2)CCCC)CCCC)/C=C/CCCCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C78H134N2/c1-7-13-19-21-23-25-27-29-31-33-35-37-38-40-42-44-46-48-50-52-54-56-58-64-78(80-76-68-66-72(60-16-10-4)74(70-76)62-18-12-6)77(79-75-67-65-71(59-15-9-3)73(69-75)61-17-11-5)63-57-55-53-51-49-47-45-43-41-39-36-34-32-30-28-26-24-22-20-14-8-2/h57,63,65-70H,7-56,59-62H2,1-6H3/b63-57+,79-77?,80-78?