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

Systemtic Name: 2,5-bis[bis(2-methoxyphenyl)amino]-4-isocyano-benzenecarbonitrile Openeye Name: 4-isocyano-2,5-bis(2-methoxy-N-(2-methoxyphenyl)anilino)benzonitrile CAS Name: 4-isocyano-2,5-bis(2-methoxy-N-(2-methoxyphenyl)anilino)benzonitrile IUPAC Name: 4-isocyano-2,5-bis(2-methoxy-N-(2-methoxyphenyl)anilino)benzonitrile Traditional Name: 4-isocyano-2,5-bis(2-methoxy-N-(2-methoxyphenyl)anilino)benzonitrile Formula: C36H30N4O4 MolecularWeight: 582.6478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N(C2=CC=CC=C2OC)C3=CC(=C(C=C3C#N)N(C4=CC=CC=C4OC)C5=CC=CC=C5OC)[N+]#[C-]

Isomeric SMILES

COC1=CC=CC=C1N(C2=CC=CC=C2OC)C3=CC(=C(C=C3C#N)N(C4=CC=CC=C4OC)C5=CC=CC=C5OC)[N+]#[C-]

InChI

InChI=1S/C36H30N4O4/c1-38-26-23-31(39(27-14-6-10-18-33(27)41-2)28-15-7-11-19-34(28)42-3)25(24-37)22-32(26)40(29-16-8-12-20-35(29)43-4)30-17-9-13-21-36(30)44-5/h6-23H,2-5H3