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

Systemtic Name: aluminum 4-(aminocarbonylamino)-2,5-bis(oxidanylidene)imidazolidine-4-carboxylate hydrochloride Openeye Name: aluminum 2,5-dioxo-4-ureido-imidazolidine-4-carboxylate hydrochloride CAS Name: aluminum 4-(carbamoylamino)-2,5-dioxo-4-imidazolidinecarboxylate hydrochloride IUPAC Name: aluminum 4-(carbamoylamino)-2,5-dioxoimidazolidine-4-carboxylate hydrochloride Traditional Name: aluminum 2,5-diketo-4-ureido-imidazolidine-4-carboxylate hydrochloride Formula: C15H16AlClN12O15 MolecularWeight: 666.793478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C5H6N4O5.Al.ClH/c3*6-3(13)8-5(2(11)12)1(10)7-4(14)9-5;;/h3*(H,11,12)(H3,6,8,13)(H2,7,9,10,14);;1H/q;;;+3;/p-3