1,3-dimethyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 1,3-dimethyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1,3-dimethyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1,3-dimethyl-5-[2-(4-morpholin-4-iumyl)ethyliminomethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 1,3-dimethyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dimethyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)barbituric acid Formula: C13H21N4O4+ MolecularWeight: 297.33024

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(C(=O)N(C1=O)C)C=NCC[NH+]2CCOCC2

Isomeric SMILES

CN1C(=O)C(C(=O)N(C1=O)C)C=NCC[NH+]2CCOCC2

InChI

InChI=1S/C13H20N4O4/c1-15-11(18)10(12(19)16(2)13(15)20)9-14-3-4-17-5-7-21-8-6-17/h9-10H,3-8H2,1-2H3/p+1