4-isocyano-2,5-bis[(E)-2-[4-[(4-methoxyphenyl)-phenyl-amino]phenyl]ethenyl]benzenecarbonitrile

Systemtic Name: 4-isocyano-2,5-bis[(E)-2-[4-[(4-methoxyphenyl)-phenyl-amino]phenyl]ethenyl]benzenecarbonitrile Openeye Name: 4-isocyano-2,5-bis[(E)-2-[4-(N-(4-methoxyphenyl)anilino)phenyl]vinyl]benzonitrile CAS Name: 4-isocyano-2,5-bis[(E)-2-[4-(N-(4-methoxyphenyl)anilino)phenyl]ethenyl]benzonitrile IUPAC Name: 4-isocyano-2,5-bis[(E)-2-[4-(N-(4-methoxyphenyl)anilino)phenyl]ethenyl]benzonitrile Traditional Name: 4-isocyano-2,5-bis[(E)-2-[4-(N-(4-methoxyphenyl)anilino)phenyl]vinyl]benzonitrile Formula: C50H38N4O2 MolecularWeight: 726.86232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=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)OC)[N+]#[C-]

Isomeric SMILES

COC1=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)OC)[N+]#[C-]

InChI

InChI=1S/C50H38N4O2/c1-52-50-35-39(20-14-37-16-22-44(23-17-37)53(42-10-6-4-7-11-42)46-26-30-48(55-2)31-27-46)41(36-51)34-40(50)21-15-38-18-24-45(25-19-38)54(43-12-8-5-9-13-43)47-28-32-49(56-3)33-29-47/h4-35H,2-3H3/b20-14+,21-15+