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

Systemtic Name: 1,3-dimethyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1,3-dimethyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: 1,3-dimethyl-5-[3-(4-morpholin-4-iumyl)propyliminomethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 1,3-dimethyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dimethyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)barbituric acid Formula: C14H23N4O4+ MolecularWeight: 311.35682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O4/c1-16-12(19)11(13(20)17(2)14(16)21)10-15-4-3-5-18-6-8-22-9-7-18/h10-11H,3-9H2,1-2H3/p+1