5,8-bis[4-(4-methyl-2-octyl-phenyl)-3-octyl-phenyl]-2,3-diphenyl-quinoxaline

Systemtic Name: 5,8-bis[4-(4-methyl-2-octyl-phenyl)-3-octyl-phenyl]-2,3-diphenyl-quinoxaline Openeye Name: 5,8-bis[4-(4-methyl-2-octyl-phenyl)-3-octyl-phenyl]-2,3-diphenyl-quinoxaline CAS Name: 5,8-bis[4-(4-methyl-2-octylphenyl)-3-octylphenyl]-2,3-diphenylquinoxaline IUPAC Name: 5,8-bis[4-(4-methyl-2-octylphenyl)-3-octylphenyl]-2,3-diphenylquinoxaline Traditional Name: 5,8-bis[4-(4-methyl-2-octyl-phenyl)-3-octyl-phenyl]-2,3-diphenyl-quinoxaline Formula: C78H98N2 MolecularWeight: 1063.62612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=CC(=C1)C)C2=C(C=C(C=C2)C3=C4C(=C(C=C3)C5=CC(=C(C=C5)C6=C(C=C(C=C6)C)CCCCCCCC)CCCCCCCC)N=C(C(=N4)C7=CC=CC=C7)C8=CC=CC=C8)CCCCCCCC

Isomeric SMILES

CCCCCCCCC1=C(C=CC(=C1)C)C2=C(C=C(C=C2)C3=C4C(=C(C=C3)C5=CC(=C(C=C5)C6=C(C=C(C=C6)C)CCCCCCCC)CCCCCCCC)N=C(C(=N4)C7=CC=CC=C7)C8=CC=CC=C8)CCCCCCCC

InChI

InChI=1S/C78H98N2/c1-7-11-15-19-23-29-41-63-55-59(5)45-49-69(63)71-51-47-67(57-65(71)43-31-25-21-17-13-9-3)73-53-54-74(78-77(73)79-75(61-37-33-27-34-38-61)76(80-78)62-39-35-28-36-40-62)68-48-52-72(66(58-68)44-32-26-22-18-14-10-4)70-50-46-60(6)56-64(70)42-30-24-20-16-12-8-2/h27-28,33-40,45-58H,7-26,29-32,41-44H2,1-6H3