aluminum 4-(aminocarbonylamino)-1,3-bis(oxidanyl)-2,5-bis(oxidanylidene)imidazolidine-4-carboxylate

Systemtic Name: aluminum 4-(aminocarbonylamino)-1,3-bis(oxidanyl)-2,5-bis(oxidanylidene)imidazolidine-4-carboxylate Openeye Name: aluminum 1,3-dihydroxy-2,5-dioxo-4-ureido-imidazolidine-4-carboxylate CAS Name: aluminum 4-(carbamoylamino)-1,3-dihydroxy-2,5-dioxo-4-imidazolidinecarboxylate IUPAC Name: aluminum 4-(carbamoylamino)-1,3-dihydroxy-2,5-dioxoimidazolidine-4-carboxylate Traditional Name: aluminum 1,3-dihydroxy-2,5-diketo-4-ureido-imidazolidine-4-carboxylate Formula: C15H15AlN12O21 MolecularWeight: 726.328938

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Descriptors Computed from Structure

Canonical SMILES:

C1(=O)C(N(C(=O)N1O)O)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1O)O)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1O)O)(C(=O)[O-])NC(=O)N.[Al+3]

Isomeric SMILES

C1(=O)C(N(C(=O)N1O)O)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1O)O)(C(=O)[O-])NC(=O)N.C1(=O)C(N(C(=O)N1O)O)(C(=O)[O-])NC(=O)N.[Al+3]

InChI

InChI=1S/3C5H6N4O7.Al/c3*6-3(13)7-5(2(11)12)1(10)8(15)4(14)9(5)16;/h3*15-16H,(H,11,12)(H3,6,7,13);/q;;;+3/p-3