1,4,7-tris(dioctoxyphosphorylmethyl)-1,4,7-triazonane

Systemtic Name: 1,4,7-tris(dioctoxyphosphorylmethyl)-1,4,7-triazonane Openeye Name: 1,4,7-tris(dioctoxyphosphorylmethyl)-1,4,7-triazonane CAS Name: 1,4,7-tris(dioctoxyphosphorylmethyl)-1,4,7-triazonane IUPAC Name: 1,4,7-tris(dioctoxyphosphorylmethyl)-1,4,7-triazonane Traditional Name: 1,4,7-tris(dioctoxyphosphorylmethyl)-1,4,7-triazonane Formula: C57H120N3O9P3 MolecularWeight: 1084.498683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOP(=O)(CN1CCN(CCN(CC1)CP(=O)(OCCCCCCCC)OCCCCCCCC)CP(=O)(OCCCCCCCC)OCCCCCCCC)OCCCCCCCC

Isomeric SMILES

CCCCCCCCOP(=O)(CN1CCN(CCN(CC1)CP(=O)(OCCCCCCCC)OCCCCCCCC)CP(=O)(OCCCCCCCC)OCCCCCCCC)OCCCCCCCC

InChI

InChI=1S/C57H120N3O9P3/c1-7-13-19-25-31-37-49-64-70(61,65-50-38-32-26-20-14-8-2)55-58-43-45-59(56-71(62,66-51-39-33-27-21-15-9-3)67-52-40-34-28-22-16-10-4)47-48-60(46-44-58)57-72(63,68-53-41-35-29-23-17-11-5)69-54-42-36-30-24-18-12-6/h7-57H2,1-6H3