5-[(2-methyl-2-morpholin-4-ium-4-yl-propyl)iminomethyl]-1,3-diazinane-2,4,6-trione

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN=CC1C(=O)NC(=O)NC1=O)[NH+]2CCOCC2

Isomeric SMILES

CC(C)(CN=CC1C(=O)NC(=O)NC1=O)[NH+]2CCOCC2

InChI

InChI=1S/C13H20N4O4/c1-13(2,17-3-5-21-6-4-17)8-14-7-9-10(18)15-12(20)16-11(9)19/h7,9H,3-6,8H2,1-2H3,(H2,15,16,18,19,20)/p+1