dialuminum; 4-(aminocarbonylamino)-1-chloranyloxy-2,5-bis(oxidanylidene)imidazolidine-4-carboxylate; 2-azanylethanoate

Systemtic Name: dialuminum; 4-(aminocarbonylamino)-1-chloranyloxy-2,5-bis(oxidanylidene)imidazolidine-4-carboxylate; 2-azanylethanoate Openeye Name: dialuminum; 2-aminoacetate; 1-chlorooxy-2,5-dioxo-4-ureido-imidazolidine-4-carboxylate CAS Name: dialuminum; 2-aminoacetate; 4-(carbamoylamino)-1-chlorooxy-2,5-dioxo-4-imidazolidinecarboxylate IUPAC Name: dialuminum; 2-aminoacetate; 4-(carbamoylamino)-1-chlorooxy-2,5-dioxoimidazolidine-4-carboxylate Traditional Name: dialuminum; 2-aminoacetate; 1-chlorooxy-2,5-diketo-4-ureido-imidazolidine-4-carboxylate Formula: C21H24Al2Cl3N15O24 MolecularWeight: 1030.823436

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])N.C(C(=O)[O-])N.C(C(=O)[O-])N.C1(=O)C(NC(=O)N1OCl)(C(=O)[O-])NC(=O)N.C1(=O)C(NC(=O)N1OCl)(C(=O)[O-])NC(=O)N.C1(=O)C(NC(=O)N1OCl)(C(=O)[O-])NC(=O)N.[Al+3].[Al+3]

Isomeric SMILES

C(C(=O)[O-])N.C(C(=O)[O-])N.C(C(=O)[O-])N.C1(=O)C(NC(=O)N1OCl)(C(=O)[O-])NC(=O)N.C1(=O)C(NC(=O)N1OCl)(C(=O)[O-])NC(=O)N.C1(=O)C(NC(=O)N1OCl)(C(=O)[O-])NC(=O)N.[Al+3].[Al+3]

InChI

InChI=1S/3C5H5ClN4O6.3C2H5NO2.2Al/c3*6-16-10-1(11)5(2(12)13,8-3(7)14)9-4(10)15;3*3-1-2(4)5;;/h3*(H,9,15)(H,12,13)(H3,7,8,14);3*1,3H2,(H,4,5);;/q;;;;;;2*+3/p-6