1-[bis(2-hydroxyethyl)amino]ethanol; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 1-[bis(2-hydroxyethyl)amino]ethanol; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 1-[bis(2-hydroxyethyl)amino]ethanol citrate CAS Name: 1-[bis(2-hydroxyethyl)amino]ethanol; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 1-[bis(2-hydroxyethyl)amino]ethanol; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 1-[bis(2-hydroxyethyl)amino]ethanol citrate Formula: C12H20NO10-3 MolecularWeight: 338.2879

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(N(CCO)CCO)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CC(N(CCO)CCO)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C6H15NO3.C6H8O7/c1-6(10)7(2-4-8)3-5-9;7-3(8)1-6(13,5(11)12)2-4(9)10/h6,8-10H,2-5H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3