1,4,7,10-tetrakis(2-diethoxyphosphorylethyl)-1,4,7,10-tetrazacyclododecane

Systemtic Name: 1,4,7,10-tetrakis(2-diethoxyphosphorylethyl)-1,4,7,10-tetrazacyclododecane Openeye Name: 1,4,7,10-tetrakis(2-diethoxyphosphorylethyl)-1,4,7,10-tetrazacyclododecane CAS Name: 1,4,7,10-tetrakis(2-diethoxyphosphorylethyl)-1,4,7,10-tetrazacyclododecane IUPAC Name: 1,4,7,10-tetrakis(2-diethoxyphosphorylethyl)-1,4,7,10-tetrazacyclododecane Traditional Name: 1,4,7,10-tetrakis(2-diethoxyphosphorylethyl)-1,4,7,10-tetrazacyclododecane Formula: C32H72N4O12P4 MolecularWeight: 828.828724

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCN1CCN(CCN(CCN(CC1)CCP(=O)(OCC)OCC)CCP(=O)(OCC)OCC)CCP(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(CCN1CCN(CCN(CCN(CC1)CCP(=O)(OCC)OCC)CCP(=O)(OCC)OCC)CCP(=O)(OCC)OCC)OCC

InChI

InChI=1S/C32H72N4O12P4/c1-9-41-49(37,42-10-2)29-25-33-17-19-34(26-30-50(38,43-11-3)44-12-4)21-23-36(28-32-52(40,47-15-7)48-16-8)24-22-35(20-18-33)27-31-51(39,45-13-5)46-14-6/h9-32H2,1-8H3