1-ethyl-3,9-dimethyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione

Systemtic Name: 1-ethyl-3,9-dimethyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione Openeye Name: 1-ethyl-3,9-dimethyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione CAS Name: 1-ethyl-3,9-dimethyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione IUPAC Name: 1-ethyl-3,9-dimethyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione Traditional Name: 1-ethyl-3,9-dimethyl-7-propyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-quinone Formula: C14H21N6O2+ MolecularWeight: 305.35554

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(NC3=[N+]2CC(=NN3CC)C)N(C1=O)C

Isomeric SMILES

CCCN1C(=O)C2=C(NC3=[N+]2CC(=NN3CC)C)N(C1=O)C

InChI

InChI=1S/C14H20N6O2/c1-5-7-18-12(21)10-11(17(4)14(18)22)15-13-19(10)8-9(3)16-20(13)6-2/h5-8H2,1-4H3/p+1