5-[(2S)-2,3-bis(oxidanyl)-1-[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]propyl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(2S)-2,3-bis(oxidanyl)-1-[2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]propyl]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2S)-2,3-dihydroxy-1-(2,4,6-trioxohexahydropyrimidin-5-yl)propyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(2S)-2,3-dihydroxy-1-(2,4,6-trioxo-1,3-diazinan-5-yl)propyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2S)-2,3-dihydroxy-1-(2,4,6-trioxo-1,3-diazinan-5-yl)propyl]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(2S)-2,3-dihydroxy-1-(2,4,6-triketohexahydropyrimidin-5-yl)propyl]barbituric acid Formula: C11H12N4O8 MolecularWeight: 328.23498

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(C1C(=O)NC(=O)NC1=O)C2C(=O)NC(=O)NC2=O)O)O

Isomeric SMILES

C([C@H](C(C1C(=O)NC(=O)NC1=O)C2C(=O)NC(=O)NC2=O)O)O

InChI

InChI=1S/C11H12N4O8/c16-1-2(17)3(4-6(18)12-10(22)13-7(4)19)5-8(20)14-11(23)15-9(5)21/h2-5,16-17H,1H2,(H2,12,13,18,19,22)(H2,14,15,20,21,23)/t2-/m1/s1