2-(2-azanylethylamino)ethanoate; nickel(3+); tetraphenylphosphanium

Systemtic Name: 2-(2-azanylethylamino)ethanoate; nickel(3+); tetraphenylphosphanium Openeye Name: nickelic; 2-(2-aminoethylamino)acetate; tetraphenylphosphonium CAS Name: 2-(2-aminoethylamino)acetate; nickel(3+); tetraphenylphosphonium IUPAC Name: 2-(2-aminoethylamino)acetate; nickel(3+); tetraphenylphosphanium Traditional Name: nickelic; 2-(2-aminoethylamino)acetate; tetraphenylphosphonium Formula: C40H56N8NiO8P MolecularWeight: 866.588601

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20P.4C4H10N2O2.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;4*5-1-2-6-3-4(7)8;/h1-20H;4*6H,1-3,5H2,(H,7,8);/q+1;;;;;+3/p-4