4-isocyano-5-[(E)-2-[4-[(4-methanoylphenyl)-phenyl-amino]phenyl]ethenyl]-2-[(E)-2-[4-[[4-(methylideneamino)phenyl]-phenyl-amino]phenyl]ethenyl]benzenecarbonitrile

Systemtic Name: 4-isocyano-5-[(E)-2-[4-[(4-methanoylphenyl)-phenyl-amino]phenyl]ethenyl]-2-[(E)-2-[4-[[4-(methylideneamino)phenyl]-phenyl-amino]phenyl]ethenyl]benzenecarbonitrile Openeye Name: 5-[(E)-2-[4-(N-(4-formylphenyl)anilino)phenyl]vinyl]-4-isocyano-2-[(E)-2-[4-(N-[4-(methyleneamino)phenyl]anilino)phenyl]vinyl]benzonitrile CAS Name: 5-[(E)-2-[4-(N-(4-formylphenyl)anilino)phenyl]ethenyl]-4-isocyano-2-[(E)-2-[4-(N-[4-(methyleneamino)phenyl]anilino)phenyl]ethenyl]benzonitrile IUPAC Name: 5-[(E)-2-[4-(N-(4-formylphenyl)anilino)phenyl]ethenyl]-4-isocyano-2-[(E)-2-[4-(N-[4-(methylideneamino)phenyl]anilino)phenyl]ethenyl]benzonitrile Traditional Name: 5-[(E)-2-[4-(N-(4-formylphenyl)anilino)phenyl]vinyl]-4-isocyano-2-[(E)-2-[4-(N-[4-(methyleneamino)phenyl]anilino)phenyl]vinyl]benzonitrile Formula: C50H35N5O MolecularWeight: 721.8458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=NC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)C=CC4=CC(=C(C=C4C#N)C=CC5=CC=C(C=C5)N(C6=CC=CC=C6)C7=CC=C(C=C7)C=O)[N+]#[C-]

Isomeric SMILES

C=NC1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)/C=C/C4=CC(=C(C=C4C#N)/C=C/C5=CC=C(C=C5)N(C6=CC=CC=C6)C7=CC=C(C=C7)C=O)[N+]#[C-]

InChI

InChI=1S/C50H35N5O/c1-52-43-23-31-49(32-24-43)55(45-11-7-4-8-12-45)47-25-15-37(16-26-47)13-21-40-34-50(53-2)41(33-42(40)35-51)22-14-38-17-27-46(28-18-38)54(44-9-5-3-6-10-44)48-29-19-39(36-56)20-30-48/h3-34,36H,1H2/b21-13+,22-14+