cobalt(3+); 1,7-dioxa-4-azacyclododecane-2,6-dione; 2-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate; tetraphenylphosphanium

Systemtic Name: cobalt(3+); 1,7-dioxa-4-azacyclododecane-2,6-dione; 2-[(2-oxidanidyl-2-oxidanylidene-ethyl)amino]ethanoate; tetraphenylphosphanium Openeye Name: cobaltic; 1,7-dioxa-4-azacyclododecane-2,6-dione; 2-[(2-oxido-2-oxo-ethyl)amino]acetate; tetraphenylphosphonium CAS Name: cobalt(3+); 1,7-dioxa-4-azacyclododecane-2,6-dione; 2-[(2-oxido-2-oxoethyl)amino]acetate; tetraphenylphosphonium IUPAC Name: cobalt(3+); 1,7-dioxa-4-azacyclododecane-2,6-dione; 2-[(2-oxido-2-oxoethyl)amino]acetate; tetraphenylphosphanium Traditional Name: cobaltic; 1,7-dioxa-4-azacyclododecane-2,6-quinone; 2-[(2-keto-2-oxido-ethyl)amino]acetate; tetraphenylphosphonium Formula: C50H60CoN4O16P MolecularWeight: 1062.935561

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(=O)CNCC(=O)OCC1.C1CCOC(=O)CNCC(=O)OCC1.C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(C(=O)[O-])NCC(=O)[O-].C(C(=O)[O-])NCC(=O)[O-].[Co+3]

Isomeric SMILES

C1CCOC(=O)CNCC(=O)OCC1.C1CCOC(=O)CNCC(=O)OCC1.C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.C(C(=O)[O-])NCC(=O)[O-].C(C(=O)[O-])NCC(=O)[O-].[Co+3]

InChI

InChI=1S/C24H20P.2C9H15NO4.2C4H7NO4.Co/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;2*11-8-6-10-7-9(12)14-5-3-1-2-4-13-8;2*6-3(7)1-5-2-4(8)9;/h1-20H;2*10H,1-7H2;2*5H,1-2H2,(H,6,7)(H,8,9);/q+1;;;;;+3/p-4