2,4,6-tris[phenyl(phenylazanyl)amino]benzene-1,3,5-tricarbonitrile

Systemtic Name: 2,4,6-tris[phenyl(phenylazanyl)amino]benzene-1,3,5-tricarbonitrile Openeye Name: 2,4,6-tris(N-anilinoanilino)benzene-1,3,5-tricarbonitrile CAS Name: 2,4,6-tris(N-anilinoanilino)benzene-1,3,5-tricarbonitrile IUPAC Name: 2,4,6-tris(N-anilinoanilino)benzene-1,3,5-tricarbonitrile Traditional Name: 2,4,6-tris(N-anilinoanilino)benzene-1,3,5-tricarbonitrile Formula: C45H33N9 MolecularWeight: 699.80382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NN(C2=CC=CC=C2)C3=C(C(=C(C(=C3C#N)N(C4=CC=CC=C4)NC5=CC=CC=C5)C#N)N(C6=CC=CC=C6)NC7=CC=CC=C7)C#N

Isomeric SMILES

C1=CC=C(C=C1)NN(C2=CC=CC=C2)C3=C(C(=C(C(=C3C#N)N(C4=CC=CC=C4)NC5=CC=CC=C5)C#N)N(C6=CC=CC=C6)NC7=CC=CC=C7)C#N

InChI

InChI=1S/C45H33N9/c46-31-40-43(52(37-25-13-4-14-26-37)49-34-19-7-1-8-20-34)41(32-47)45(54(39-29-17-6-18-30-39)51-36-23-11-3-12-24-36)42(33-48)44(40)53(38-27-15-5-16-28-38)50-35-21-9-2-10-22-35/h1-30,49-51H