4-isocyano-2,5-bis[(E)-2-[4-[(4-methylphenyl)-naphthalen-1-yl-amino]phenyl]ethenyl]benzenecarbonitrile

Systemtic Name: 4-isocyano-2,5-bis[(E)-2-[4-[(4-methylphenyl)-naphthalen-1-yl-amino]phenyl]ethenyl]benzenecarbonitrile Openeye Name: 4-isocyano-2,5-bis[(E)-2-[4-[4-methyl-N-(1-naphthyl)anilino]phenyl]vinyl]benzonitrile CAS Name: 4-isocyano-2,5-bis[(E)-2-[4-[4-methyl-N-(1-naphthalenyl)anilino]phenyl]ethenyl]benzonitrile IUPAC Name: 4-isocyano-2,5-bis[(E)-2-[4-(4-methyl-N-naphthalen-1-ylanilino)phenyl]ethenyl]benzonitrile Traditional Name: 4-isocyano-2,5-bis[(E)-2-[4-[4-methyl-N-(1-naphthyl)anilino]phenyl]vinyl]benzonitrile Formula: C58H42N4 MolecularWeight: 794.98088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)C=CC3=CC(=C(C=C3C#N)C=CC4=CC=C(C=C4)N(C5=CC=C(C=C5)C)C6=CC=CC7=CC=CC=C76)[N+]#[C-])C8=CC=CC9=CC=CC=C98

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=CC=C(C=C2)/C=C/C3=CC(=C(C=C3C#N)/C=C/C4=CC=C(C=C4)N(C5=CC=C(C=C5)C)C6=CC=CC7=CC=CC=C76)[N+]#[C-])C8=CC=CC9=CC=CC=C98

InChI

InChI=1S/C58H42N4/c1-41-18-30-50(31-19-41)61(57-16-8-12-45-10-4-6-14-54(45)57)52-34-24-43(25-35-52)22-28-47-39-56(60-3)48(38-49(47)40-59)29-23-44-26-36-53(37-27-44)62(51-32-20-42(2)21-33-51)58-17-9-13-46-11-5-7-15-55(46)58/h4-39H,1-2H3/b28-22+,29-23+