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

Systemtic Name: (5R)-1-cycloheptyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1,3-diazinane-2,4,6-trione Openeye Name: (5R)-1-cycloheptyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)hexahydropyrimidine-2,4,6-trione CAS Name: (5R)-1-cycloheptyl-5-[3-(4-morpholin-4-iumyl)propyliminomethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: (5R)-1-cycloheptyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)-1,3-diazinane-2,4,6-trione Traditional Name: (5R)-1-cycloheptyl-5-(3-morpholin-4-ium-4-ylpropyliminomethyl)barbituric acid Formula: C19H31N4O4+ MolecularWeight: 379.47384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N2C(=O)C(C(=O)NC2=O)C=NCCC[NH+]3CCOCC3

Isomeric SMILES

C1CCCC(CC1)N2C(=O)[C@@H](C(=O)NC2=O)C=NCCC[NH+]3CCOCC3

InChI

InChI=1S/C19H30N4O4/c24-17-16(14-20-8-5-9-22-10-12-27-13-11-22)18(25)23(19(26)21-17)15-6-3-1-2-4-7-15/h14-16H,1-13H2,(H,21,24,26)/p+1/t16-/m1/s1