3-methyl-8-(morpholin-4-ium-4-ylmethyl)-7H-purine-2,6-dione

Systemtic Name: 3-methyl-8-(morpholin-4-ium-4-ylmethyl)-7H-purine-2,6-dione Openeye Name: 3-methyl-8-(morpholin-4-ium-4-ylmethyl)-7H-purine-2,6-dione CAS Name: 3-methyl-8-(4-morpholin-4-iumylmethyl)-7H-purine-2,6-dione IUPAC Name: 3-methyl-8-(morpholin-4-ium-4-ylmethyl)-7H-purine-2,6-dione Traditional Name: 3-methyl-8-(morpholin-4-ium-4-ylmethyl)-7H-purine-2,6-quinone Formula: C11H16N5O3+ MolecularWeight: 266.27644

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)NC(=N2)C[NH+]3CCOCC3

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)NC(=N2)C[NH+]3CCOCC3

InChI

InChI=1S/C11H15N5O3/c1-15-9-8(10(17)14-11(15)18)12-7(13-9)6-16-2-4-19-5-3-16/h2-6H2,1H3,(H,12,13)(H,14,17,18)/p+1