1,2,2-tris(dioctylphosphorylmethyl)-1,4,7-triazonane

Systemtic Name: 1,2,2-tris(dioctylphosphorylmethyl)-1,4,7-triazonane Openeye Name: 1,2,2-tris(dioctylphosphorylmethyl)-1,4,7-triazonane CAS Name: 1,2,2-tris(dioctylphosphorylmethyl)-1,4,7-triazonane IUPAC Name: 1,2,2-tris(dioctylphosphorylmethyl)-1,4,7-triazonane Traditional Name: 1,2,2-tris(dioctylphosphorylmethyl)-1,4,7-triazonane Formula: C57H120N3O3P3 MolecularWeight: 988.502283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCP(=O)(CCCCCCCC)CC1(CNCCNCCN1CP(=O)(CCCCCCCC)CCCCCCCC)CP(=O)(CCCCCCCC)CCCCCCCC

Isomeric SMILES

CCCCCCCCP(=O)(CCCCCCCC)CC1(CNCCNCCN1CP(=O)(CCCCCCCC)CCCCCCCC)CP(=O)(CCCCCCCC)CCCCCCCC

InChI

InChI=1S/C57H120N3O3P3/c1-7-13-19-25-31-37-47-64(61,48-38-32-26-20-14-8-2)54-57(55-65(62,49-39-33-27-21-15-9-3)50-40-34-28-22-16-10-4)53-59-44-43-58-45-46-60(57)56-66(63,51-41-35-29-23-17-11-5)52-42-36-30-24-18-12-6/h58-59H,7-56H2,1-6H3