5-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(4-methylpiperazine-1,4-diium-1-yl)methyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(4-methylpiperazine-1,4-diium-1-yl)methyl]barbituric acid Formula: C10H18N4O3+2 MolecularWeight: 242.27492

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CC2C(=O)NC(=O)NC2=O

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CC2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C10H16N4O3/c1-13-2-4-14(5-3-13)6-7-8(15)11-10(17)12-9(7)16/h7H,2-6H2,1H3,(H2,11,12,15,16,17)/p+2