N5,N6-bis(4-tricosylphenyl)hentriacont-7-yne-5,6-diimine

Systemtic Name: N5,N6-bis(4-tricosylphenyl)hentriacont-7-yne-5,6-diimine Openeye Name: N5,N6-bis(4-tricosylphenyl)hentriacont-7-yne-5,6-diimine CAS Name: N5,N6-bis(4-tricosylphenyl)-7-hentriacontyne-5,6-diimine IUPAC Name: 5-N,6-N-bis(4-tricosylphenyl)hentriacont-7-yne-5,6-diimine Traditional Name: 1-[C-butyl-N-(4-tricosylphenyl)carbonimidoyl]hexacos-2-ynylidene-(4-tricosylphenyl)amine Formula: C89H158N2 MolecularWeight: 1256.22022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C89H158N2/c1-5-9-13-16-19-22-25-28-31-34-37-40-41-44-47-50-53-56-59-62-65-68-71-75-89(91-87-82-78-85(79-83-87)73-70-67-64-61-58-55-52-49-46-43-39-36-33-30-27-24-21-18-15-11-7-3)88(74-12-8-4)90-86-80-76-84(77-81-86)72-69-66-63-60-57-54-51-48-45-42-38-35-32-29-26-23-20-17-14-10-6-2/h76-83H,5-70,72-74H2,1-4H3