1,3,5-tris(4-phenyldiazenylphenyl)-1,3,5-triazinane-2,4,6-trione

Systemtic Name: 1,3,5-tris(4-phenyldiazenylphenyl)-1,3,5-triazinane-2,4,6-trione Openeye Name: 1,3,5-tris(4-phenylazophenyl)-1,3,5-triazinane-2,4,6-trione CAS Name: 1,3,5-tris(4-phenyldiazenylphenyl)-1,3,5-triazinane-2,4,6-trione IUPAC Name: 1,3,5-tris(4-phenyldiazenylphenyl)-1,3,5-triazinane-2,4,6-trione Traditional Name: 1,3,5-tris(4-phenylazophenyl)isocyanuric acid Formula: C39H27N9O3 MolecularWeight: 669.69018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N3C(=O)N(C(=O)N(C3=O)C4=CC=C(C=C4)N=NC5=CC=CC=C5)C6=CC=C(C=C6)N=NC7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N3C(=O)N(C(=O)N(C3=O)C4=CC=C(C=C4)N=NC5=CC=CC=C5)C6=CC=C(C=C6)N=NC7=CC=CC=C7

InChI

InChI=1S/C39H27N9O3/c49-37-46(34-22-16-31(17-23-34)43-40-28-10-4-1-5-11-28)38(50)48(36-26-20-33(21-27-36)45-42-30-14-8-3-9-15-30)39(51)47(37)35-24-18-32(19-25-35)44-41-29-12-6-2-7-13-29/h1-27H