3-tert-butyl-7-ethyl-9-methyl-1-propan-2-yl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione

Systemtic Name: 3-tert-butyl-7-ethyl-9-methyl-1-propan-2-yl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione Openeye Name: 3-tert-butyl-7-ethyl-1-isopropyl-9-methyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione CAS Name: 3-tert-butyl-7-ethyl-9-methyl-1-propan-2-yl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione IUPAC Name: 3-tert-butyl-7-ethyl-9-methyl-1-propan-2-yl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-dione Traditional Name: 3-tert-butyl-7-ethyl-1-isopropyl-9-methyl-4,10-dihydropurino[8,7-c][1,2,4]triazin-5-ium-6,8-quinone Formula: C17H27N6O2+ MolecularWeight: 347.43528

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(NC3=[N+]2CC(=NN3C(C)C)C(C)(C)C)N(C1=O)C

Isomeric SMILES

CCN1C(=O)C2=C(NC3=[N+]2CC(=NN3C(C)C)C(C)(C)C)N(C1=O)C

InChI

InChI=1S/C17H26N6O2/c1-8-21-14(24)12-13(20(7)16(21)25)18-15-22(12)9-11(17(4,5)6)19-23(15)10(2)3/h10H,8-9H2,1-7H3/p+1