N3-(2-nonacos-3-ynylphenyl)-N4-(4-tridecylphenyl)dodecane-3,4-diimine

Systemtic Name: N3-(2-nonacos-3-ynylphenyl)-N4-(4-tridecylphenyl)dodecane-3,4-diimine Openeye Name: N3-(2-nonacos-3-ynylphenyl)-N4-(4-tridecylphenyl)dodecane-3,4-diimine CAS Name: N3-(2-nonacos-3-ynylphenyl)-N4-(4-tridecylphenyl)dodecane-3,4-diimine IUPAC Name: 3-N-(2-nonacos-3-ynylphenyl)-4-N-(4-tridecylphenyl)dodecane-3,4-diimine Traditional Name: 1-[C-ethyl-N-(2-nonacos-3-ynylphenyl)carbonimidoyl]nonylidene-(4-tridecylphenyl)amine Formula: C66H112N2 MolecularWeight: 933.60888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCC#CCCC1=CC=CC=C1N=C(CC)C(=NC2=CC=C(C=C2)CCCCCCCCCCCCC)CCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCC#CCCC1=CC=CC=C1N=C(CC)C(=NC2=CC=C(C=C2)CCCCCCCCCCCCC)CCCCCCCC

InChI

InChI=1S/C66H112N2/c1-5-9-12-15-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-41-43-45-48-53-62-54-50-51-55-65(62)68-64(8-4)66(56-49-46-17-14-11-7-3)67-63-59-57-61(58-60-63)52-47-44-42-40-38-21-19-16-13-10-6-2/h50-51,54-55,57-60H,5-42,44,46-49,52-53,56H2,1-4H3