N6-[2-[(E)-heptacos-3-enyl]phenyl]-N5-(4-heptacosylphenyl)decane-5,6-diimine

Systemtic Name: N6-[2-[(E)-heptacos-3-enyl]phenyl]-N5-(4-heptacosylphenyl)decane-5,6-diimine Openeye Name: N6-[2-[(E)-heptacos-3-enyl]phenyl]-N5-(4-heptacosylphenyl)decane-5,6-diimine CAS Name: N6-[2-[(E)-heptacos-3-enyl]phenyl]-N5-(4-heptacosylphenyl)decane-5,6-diimine IUPAC Name: 6-N-[2-[(E)-heptacos-3-enyl]phenyl]-5-N-(4-heptacosylphenyl)decane-5,6-diimine Traditional Name: [1-butyl-2-[2-[(E)-heptacos-3-enyl]phenyl]imino-hexylidene]-(4-heptacosylphenyl)amine Formula: C76H134N2 MolecularWeight: 1075.89056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)N=C(CCCC)C(=NC2=CC=CC=C2CCC=CCCCCCCCCCCCCCCCCCCCCCCC)CCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)N=C(CCCC)C(=NC2=CC=CC=C2CC/C=C/CCCCCCCCCCCCCCCCCCCCCCC)CCCC

InChI

InChI=1S/C76H134N2/c1-5-9-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-57-61-71-67-69-73(70-68-71)77-75(64-11-7-3)76(65-12-8-4)78-74-66-60-59-63-72(74)62-58-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-10-6-2/h54,56,59-60,63,66-70H,5-53,55,57-58,61-62,64-65H2,1-4H3/b56-54+,77-75?,78-76?