N7,N8-bis(3,5-dibutylphenyl)heptacos-9-yne-7,8-diimine

Systemtic Name: N7,N8-bis(3,5-dibutylphenyl)heptacos-9-yne-7,8-diimine Openeye Name: N7,N8-bis(3,5-dibutylphenyl)heptacos-9-yne-7,8-diimine CAS Name: N7,N8-bis(3,5-dibutylphenyl)-9-heptacosyne-7,8-diimine IUPAC Name: 7-N,8-N-bis(3,5-dibutylphenyl)heptacos-9-yne-7,8-diimine Traditional Name: (3,5-dibutylphenyl)-[1-[N-(3,5-dibutylphenyl)-C-hexyl-carbonimidoyl]eicos-2-ynylidene]amine Formula: C55H90N2 MolecularWeight: 779.3165

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC#CC(=NC1=CC(=CC(=C1)CCCC)CCCC)C(=NC2=CC(=CC(=C2)CCCC)CCCC)CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC#CC(=NC1=CC(=CC(=C1)CCCC)CCCC)C(=NC2=CC(=CC(=C2)CCCC)CCCC)CCCCCC

InChI

InChI=1S/C55H90N2/c1-7-13-19-21-22-23-24-25-26-27-28-29-30-31-32-33-35-41-55(57-53-46-50(38-17-11-5)43-51(47-53)39-18-12-6)54(40-34-20-14-8-2)56-52-44-48(36-15-9-3)42-49(45-52)37-16-10-4/h42-47H,7-34,36-40H2,1-6H3