3,7-bis[(E)-2-[4-(diphenylamino)phenyl]ethenyl]-5-isocyano-anthracene-1-carbonitrile

Systemtic Name: 3,7-bis[(E)-2-[4-(diphenylamino)phenyl]ethenyl]-5-isocyano-anthracene-1-carbonitrile Openeye Name: 5-isocyano-3,7-bis[(E)-2-[4-(N-phenylanilino)phenyl]vinyl]anthracene-1-carbonitrile CAS Name: 5-isocyano-3,7-bis[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]-1-anthracenecarbonitrile IUPAC Name: 5-isocyano-3,7-bis[(E)-2-[4-(N-phenylanilino)phenyl]ethenyl]anthracene-1-carbonitrile Traditional Name: 5-isocyano-3,7-bis[(E)-2-[4-(N-phenylanilino)phenyl]vinyl]anthracene-1-carbonitrile Formula: C56H38N4 MolecularWeight: 766.92772

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC(=CC2=CC3=C(C=C(C=C3C#N)C=CC4=CC=C(C=C4)N(C5=CC=CC=C5)C6=CC=CC=C6)C=C21)C=CC7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

[C-]#[N+]C1=CC(=CC2=CC3=C(C=C(C=C3C#N)/C=C/C4=CC=C(C=C4)N(C5=CC=CC=C5)C6=CC=CC=C6)C=C21)/C=C/C7=CC=C(C=C7)N(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C56H38N4/c1-58-56-37-44(25-23-42-28-32-53(33-29-42)60(50-18-10-4-11-19-50)51-20-12-5-13-21-51)35-46-38-54-45(39-55(46)56)34-43(36-47(54)40-57)24-22-41-26-30-52(31-27-41)59(48-14-6-2-7-15-48)49-16-8-3-9-17-49/h2-39H/b24-22+,25-23+