1,1,4-triethyl-1,2,4-triazolidin-1-ium-3,5-dione

Systemtic Name: 1,1,4-triethyl-1,2,4-triazolidin-1-ium-3,5-dione Openeye Name: 1,1,4-triethyl-1,2,4-triazolidin-1-ium-3,5-dione CAS Name: 1,1,4-triethyl-1,2,4-triazolidin-1-ium-3,5-dione IUPAC Name: 1,1,4-triethyl-1,2,4-triazolidin-1-ium-3,5-dione Traditional Name: 1,1,4-triethyl-1,2,4-triazolidin-1-ium-3,5-quinone Formula: C8H16N3O2+ MolecularWeight: 186.23154

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)N[N+](C1=O)(CC)CC

Isomeric SMILES

CCN1C(=O)N[N+](C1=O)(CC)CC

InChI

InChI=1S/C8H15N3O2/c1-4-10-7(12)9-11(5-2,6-3)8(10)13/h4-6H2,1-3H3/p+1