2-[bis(2-hydroxyethyl)amino]ethanol; diphosphono hydrogen phosphate

Systemtic Name: 2-[bis(2-hydroxyethyl)amino]ethanol; diphosphono hydrogen phosphate Openeye Name: 2-[bis(2-hydroxyethyl)amino]ethanol; diphosphono hydrogen phosphate CAS Name: 2-[bis(2-hydroxyethyl)amino]ethanol; diphosphono hydrogen phosphate IUPAC Name: 2-[bis(2-hydroxyethyl)amino]ethanol; diphosphono hydrogen phosphate Traditional Name: 2-[bis(2-hydroxyethyl)amino]ethanol; diphosphono hydrogen phosphate Formula: C24H65N4O22P3 MolecularWeight: 854.707783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.OP(=O)(O)OP(=O)(O)OP(=O)(O)O

Isomeric SMILES

C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.C(CO)N(CCO)CCO.OP(=O)(O)OP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/4C6H15NO3.H5O10P3/c4*8-4-1-7(2-5-9)3-6-10;1-11(2,3)9-13(7,8)10-12(4,5)6/h4*8-10H,1-6H2;(H,7,8)(H2,1,2,3)(H2,4,5,6)