2-[diethylaminooxy-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]propane-1,2,3-tricarboxylate; nickel(3+); tetraphenylphosphanium

Systemtic Name: 2-[diethylaminooxy-(2-oxidanidyl-2-oxidanylidene-ethyl)amino]propane-1,2,3-tricarboxylate; nickel(3+); tetraphenylphosphanium Openeye Name: nickelic; 2-[diethylaminooxy-(2-oxido-2-oxo-ethyl)amino]propane-1,2,3-tricarboxylate; tetraphenylphosphonium CAS Name: 2-[diethylaminooxy-(2-oxido-2-oxoethyl)amino]propane-1,2,3-tricarboxylate; nickel(3+); tetraphenylphosphonium IUPAC Name: 2-[diethylaminooxy-(2-oxido-2-oxoethyl)amino]propane-1,2,3-tricarboxylate; nickel(3+); tetraphenylphosphanium Traditional Name: nickelic; 2-[diethylaminooxy-(2-keto-2-oxido-ethyl)amino]propane-1,2,3-tricarboxylate; tetraphenylphosphonium Formula: C36H36N2NiO9P MolecularWeight: 730.346201

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)ON(CC(=O)[O-])C(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-].C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Ni+3]

Isomeric SMILES

CCN(CC)ON(CC(=O)[O-])C(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-].C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Ni+3]

InChI

InChI=1S/C24H20P.C12H20N2O9.Ni/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-3-13(4-2)23-14(7-10(19)20)12(11(21)22,5-8(15)16)6-9(17)18;/h1-20H;3-7H2,1-2H3,(H,15,16)(H,17,18)(H,19,20)(H,21,22);/q+1;;+3/p-4