aluminum 4-(aminocarbonylamino)-3-chloranyl-2,5-bis(oxidanylidene)imidazolidine-4-carboxylate

Systemtic Name: aluminum 4-(aminocarbonylamino)-3-chloranyl-2,5-bis(oxidanylidene)imidazolidine-4-carboxylate Openeye Name: aluminum 3-chloro-2,5-dioxo-4-ureido-imidazolidine-4-carboxylate CAS Name: aluminum 4-(carbamoylamino)-3-chloro-2,5-dioxo-4-imidazolidinecarboxylate IUPAC Name: aluminum 4-(carbamoylamino)-3-chloro-2,5-dioxoimidazolidine-4-carboxylate Traditional Name: aluminum 3-chloro-2,5-diketo-4-ureido-imidazolidine-4-carboxylate Formula: C15H12AlCl3N12O15 MolecularWeight: 733.667718

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Descriptors Computed from Structure

Canonical SMILES:

C1(=O)C(N(C(=O)N1)Cl)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1)Cl)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1)Cl)(C(=O)[O-])NC(=O)N.[Al+3]

Isomeric SMILES

C1(=O)C(N(C(=O)N1)Cl)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1)Cl)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1)Cl)(C(=O)[O-])NC(=O)N.[Al+3]

InChI

InChI=1S/3C5H5ClN4O5.Al/c3*6-10-4(15)8-1(11)5(10,2(12)13)9-3(7)14;/h3*(H,12,13)(H3,7,9,14)(H,8,11,15);/q;;;+3/p-3