2,4,6-tris[bis(phenylmethyl)phosphoryl]pyrimidine

Systemtic Name: 2,4,6-tris[bis(phenylmethyl)phosphoryl]pyrimidine Openeye Name: 2,4,6-tris(dibenzylphosphoryl)pyrimidine CAS Name: 2,4,6-tris[bis(phenylmethyl)phosphoryl]pyrimidine IUPAC Name: 2,4,6-tris(dibenzylphosphoryl)pyrimidine Traditional Name: 2,4,6-tris(dibenzylphosphoryl)pyrimidine Formula: C46H43N2O3P3 MolecularWeight: 764.766503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CP(=O)(CC2=CC=CC=C2)C3=CC(=NC(=N3)P(=O)(CC4=CC=CC=C4)CC5=CC=CC=C5)P(=O)(CC6=CC=CC=C6)CC7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)CP(=O)(CC2=CC=CC=C2)C3=CC(=NC(=N3)P(=O)(CC4=CC=CC=C4)CC5=CC=CC=C5)P(=O)(CC6=CC=CC=C6)CC7=CC=CC=C7

InChI

InChI=1S/C46H43N2O3P3/c49-52(32-38-19-7-1-8-20-38,33-39-21-9-2-10-22-39)44-31-45(53(50,34-40-23-11-3-12-24-40)35-41-25-13-4-14-26-41)48-46(47-44)54(51,36-42-27-15-5-16-28-42)37-43-29-17-6-18-30-43/h1-31H,32-37H2