6-piperazin-4-ium-1-yl-2H-1,2,4-triazine-3,5-dione

Systemtic Name: 6-piperazin-4-ium-1-yl-2H-1,2,4-triazine-3,5-dione Openeye Name: 6-piperazin-4-ium-1-yl-2H-1,2,4-triazine-3,5-dione CAS Name: 6-(1-piperazin-4-iumyl)-2H-1,2,4-triazine-3,5-dione IUPAC Name: 6-piperazin-4-ium-1-yl-2H-1,2,4-triazine-3,5-dione Traditional Name: 6-piperazin-4-ium-1-yl-2H-1,2,4-triazine-3,5-quinone Formula: C7H12N5O2+ MolecularWeight: 198.20248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NNC(=O)NC2=O

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NNC(=O)NC2=O

InChI

InChI=1S/C7H11N5O2/c13-6-5(10-11-7(14)9-6)12-3-1-8-2-4-12/h8H,1-4H2,(H2,9,11,13,14)/p+1