1,2,2-tris(diethylphosphorylmethyl)-1,4,7,10-tetrazacyclododecane

Systemtic Name: 1,2,2-tris(diethylphosphorylmethyl)-1,4,7,10-tetrazacyclododecane Openeye Name: 1,2,2-tris(diethylphosphorylmethyl)-1,4,7,10-tetrazacyclododecane CAS Name: 1,2,2-tris(diethylphosphorylmethyl)-1,4,7,10-tetrazacyclododecane IUPAC Name: 1,2,2-tris(diethylphosphorylmethyl)-1,4,7,10-tetrazacyclododecane Traditional Name: 1,2,2-tris(diethylphosphorylmethyl)-1,4,7,10-tetrazacyclododecane Formula: C23H53N4O3P3 MolecularWeight: 526.613203

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Descriptors Computed from Structure

Canonical SMILES:

CCP(=O)(CC)CC1(CNCCNCCNCCN1CP(=O)(CC)CC)CP(=O)(CC)CC

Isomeric SMILES

CCP(=O)(CC)CC1(CNCCNCCNCCN1CP(=O)(CC)CC)CP(=O)(CC)CC

InChI

InChI=1S/C23H53N4O3P3/c1-7-31(28,8-2)20-23(21-32(29,9-3)10-4)19-26-16-15-24-13-14-25-17-18-27(23)22-33(30,11-5)12-6/h24-26H,7-22H2,1-6H3