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

Systemtic Name: (5R)-1-butyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5R)-1-butyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5R)-1-butyl-5-[2-(4-morpholin-4-iumyl)ethyliminomethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: (5R)-1-butyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5R)-1-butyl-5-(2-morpholin-4-ium-4-ylethyliminomethyl)barbituric acid Formula: C15H25N4O4+ MolecularWeight: 325.3834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(C(=O)NC1=O)C=NCC[NH+]2CCOCC2

Isomeric SMILES

CCCCN1C(=O)[C@@H](C(=O)NC1=O)C=NCC[NH+]2CCOCC2

InChI

InChI=1S/C15H24N4O4/c1-2-3-5-19-14(21)12(13(20)17-15(19)22)11-16-4-6-18-7-9-23-10-8-18/h11-12H,2-10H2,1H3,(H,17,20,22)/p+1/t12-/m1/s1