4-methyl-6-(2-morpholin-4-ium-4-ylethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-6-(2-morpholin-4-ium-4-ylethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 4-methyl-6-(2-morpholin-4-ium-4-ylethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-6-[2-(4-morpholin-4-iumyl)ethyl]-7,8-dihydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-methyl-6-(2-morpholin-4-ium-4-ylethyl)-7,8-dihydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 4-methyl-6-(2-morpholin-4-ium-4-ylethyl)-7,8-dihydropurin[7,8-a]imidazole-1,3-quinone Formula: C14H21N6O3+ MolecularWeight: 321.35494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N3CCN(C3=N2)CC[NH+]4CCOCC4

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N3CCN(C3=N2)CC[NH+]4CCOCC4

InChI

InChI=1S/C14H20N6O3/c1-17-11-10(12(21)16-14(17)22)20-5-4-19(13(20)15-11)3-2-18-6-8-23-9-7-18/h2-9H2,1H3,(H,16,21,22)/p+1