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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C2=CC=CC=C12)N(C3=CC=CC=C3)C4=CC=C(C=C4)C=CC5=CC(=C(C=C5C#N)C=CC6=CC=C(C=C6)N(C7=CC=CC=C7)C8=CC=C(C9=CC=CC=C98)C)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C2=CC=CC=C12)N(C3=CC=CC=C3)C4=CC=C(C=C4)/C=C/C5=CC(=C(C=C5C#N)/C=C/C6=CC=C(C=C6)N(C7=CC=CC=C7)C8=CC=C(C9=CC=CC=C98)C)[N+]#[C-]

InChI

InChI=1S/C58H42N4/c1-41-22-36-57(54-20-12-10-18-52(41)54)61(48-14-6-4-7-15-48)50-32-26-43(27-33-50)24-30-45-39-56(60-3)46(38-47(45)40-59)31-25-44-28-34-51(35-29-44)62(49-16-8-5-9-17-49)58-37-23-42(2)53-19-11-13-21-55(53)58/h4-39H,1-2H3/b30-24+,31-25+