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

Systemtic Name: (5S)-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione Openeye Name: (5S)-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1-phenyl-hexahydropyrimidine-2,4,6-trione CAS Name: (5S)-5-[2-(4-morpholin-4-iumyl)ethyliminomethyl]-1-phenyl-1,3-diazinane-2,4,6-trione IUPAC Name: (5S)-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1-phenyl-1,3-diazinane-2,4,6-trione Traditional Name: (5S)-5-(2-morpholin-4-ium-4-ylethyliminomethyl)-1-phenyl-barbituric acid Formula: C17H21N4O4+ MolecularWeight: 345.37304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN=CC2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3

Isomeric SMILES

C1COCC[NH+]1CCN=C[C@H]2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3

InChI

InChI=1S/C17H20N4O4/c22-15-14(12-18-6-7-20-8-10-25-11-9-20)16(23)21(17(24)19-15)13-4-2-1-3-5-13/h1-5,12,14H,6-11H2,(H,19,22,24)/p+1/t14-/m0/s1